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Novel 1,3-Indanedione-Thiazole Hybrids as Small-Molecule SARS-COV-2 Main Protease Inhibitors With Potential anti-Coronaviral Activity 新型 1,3-茚二酮-噻唑杂环作为具有潜在抗柯那病毒活性的小分子 SARS-COV-2 主要蛋白酶抑制剂
IF 2.4 3区 化学
Polycyclic Aromatic Compounds Pub Date : 2024-03-07 DOI: 10.1080/10406638.2024.2318442
Thoraya A. Farghaly, Ghada S. Masaret, Hanan Gaber Abdulwahab
{"title":"Novel 1,3-Indanedione-Thiazole Hybrids as Small-Molecule SARS-COV-2 Main Protease Inhibitors With Potential anti-Coronaviral Activity","authors":"Thoraya A. Farghaly, Ghada S. Masaret, Hanan Gaber Abdulwahab","doi":"10.1080/10406638.2024.2318442","DOIUrl":"https://doi.org/10.1080/10406638.2024.2318442","url":null,"abstract":"Since arising in 2019, COVID 19 has been causing rapidly-increasing mortality and morbidity rates across the globe. Herein, novel 1,3-indanedione-thiazole hybrids were designed and synthesized as s...","PeriodicalId":20303,"journal":{"name":"Polycyclic Aromatic Compounds","volume":null,"pages":null},"PeriodicalIF":2.4,"publicationDate":"2024-03-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"140072355","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Applications of Truxene and Its Congeners in Solar Cells: A Recent Update 楚克森及其同系物在太阳能电池中的应用：最新进展
IF 2.4 3区 化学
Polycyclic Aromatic Compounds Pub Date : 2024-02-26 DOI: 10.1080/10406638.2024.2317859
Rashid Ali, Shakeel Alvi, Mahim Sattar
{"title":"Applications of Truxene and Its Congeners in Solar Cells: A Recent Update","authors":"Rashid Ali, Shakeel Alvi, Mahim Sattar","doi":"10.1080/10406638.2024.2317859","DOIUrl":"https://doi.org/10.1080/10406638.2024.2317859","url":null,"abstract":"A variety of reports on the truxene and its derivatives have marked the embarkment of the incredible modern era in diverse fields for the human welfare. Among the various potential applications of ...","PeriodicalId":20303,"journal":{"name":"Polycyclic Aromatic Compounds","volume":null,"pages":null},"PeriodicalIF":2.4,"publicationDate":"2024-02-26","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"139980120","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Synthesis, Characterization, Crystal Structure, and Theoretical Calculations of Novel 1,5-Benzodiazepine Derivatives Obtained via 1,3-Dipolar Cycloaddition Reactions 通过 1,3-Dipolar Cycloaddition 反应获得的新型 1,5-苯并二氮杂卓衍生物的合成、表征、晶体结构和理论计算
IF 2.4 3区 化学
Polycyclic Aromatic Compounds Pub Date : 2024-02-22 DOI: 10.1080/10406638.2024.2316016
Samir Hmaimou, Mohamed Adardour, Marouane Ait Lahcen, Walid Ettahiri, Sanae Lahmidi, Joel T. Mague, Mustapha Taleb, Mohamed Maatallah, Abdesselam Baouid
{"title":"Synthesis, Characterization, Crystal Structure, and Theoretical Calculations of Novel 1,5-Benzodiazepine Derivatives Obtained via 1,3-Dipolar Cycloaddition Reactions","authors":"Samir Hmaimou, Mohamed Adardour, Marouane Ait Lahcen, Walid Ettahiri, Sanae Lahmidi, Joel T. Mague, Mustapha Taleb, Mohamed Maatallah, Abdesselam Baouid","doi":"10.1080/10406638.2024.2316016","DOIUrl":"https://doi.org/10.1080/10406638.2024.2316016","url":null,"abstract":"A series of triazolo-benzodiazepine derivatives were synthesized by the condensation of 2,2,4-trimethyl-2,3-dihydro-1H-1,5-benzodiazepine (BZD) 1 with nitrilimine analogs (N-aryl-C-ethoxycarbonyl-n...","PeriodicalId":20303,"journal":{"name":"Polycyclic Aromatic Compounds","volume":null,"pages":null},"PeriodicalIF":2.4,"publicationDate":"2024-02-22","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"139919934","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Synthesis, Characterization and Biological Applications of New Guanidinium and Aminoguanidinium Salts of 6-Hydroxypyridine-3-Carboxylic Acid 6-羟基吡啶-3-羧酸的新型胍盐和氨基胍盐的合成、表征和生物应用
IF 2.4 3区 化学
Polycyclic Aromatic Compounds Pub Date : 2024-02-19 DOI: 10.1080/10406638.2024.2311699
Prabha Devi Balakrishnan, Sangeedha Appusamy, Kanchana Ponnusamy
{"title":"Synthesis, Characterization and Biological Applications of New Guanidinium and Aminoguanidinium Salts of 6-Hydroxypyridine-3-Carboxylic Acid","authors":"Prabha Devi Balakrishnan, Sangeedha Appusamy, Kanchana Ponnusamy","doi":"10.1080/10406638.2024.2311699","DOIUrl":"https://doi.org/10.1080/10406638.2024.2311699","url":null,"abstract":"The reaction of 6-hydroxypyridine-3-carboxylic acid with guanidine bicarbonate and aminoguanidine hydrogen carbonate, in different molar ratios (1:1, 1:2, and 2:1) yield salts of composition[GunH][...","PeriodicalId":20303,"journal":{"name":"Polycyclic Aromatic Compounds","volume":null,"pages":null},"PeriodicalIF":2.4,"publicationDate":"2024-02-19","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"139948732","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
1,2,3-Triazolyl Phenylhydrazones as Antioxidant Agents: An Ultrasound Promoted Catalyst-Free Synthesis and Molecular Docking Study 作为抗氧化剂的 1,2,3-三唑基苯肼：超声促进的无催化剂合成及分子对接研究
IF 2.4 3区 化学
Polycyclic Aromatic Compounds Pub Date : 2024-02-13 DOI: 10.1080/10406638.2024.2309358
Smita P. Khare, Tejshri R. Deshmukh, Jaiprakash N. Sangshetti, Vijay M. Khedkar, Bapurao B. Shingate
{"title":"1,2,3-Triazolyl Phenylhydrazones as Antioxidant Agents: An Ultrasound Promoted Catalyst-Free Synthesis and Molecular Docking Study","authors":"Smita P. Khare, Tejshri R. Deshmukh, Jaiprakash N. Sangshetti, Vijay M. Khedkar, Bapurao B. Shingate","doi":"10.1080/10406638.2024.2309358","DOIUrl":"https://doi.org/10.1080/10406638.2024.2309358","url":null,"abstract":"An efficient, ultrasound assisted catalyst-free, green protocol has been developed for the synthesis of 1,2,3-triazolyl phenylhydrazone derivatives under environmentally benign condition. The antio...","PeriodicalId":20303,"journal":{"name":"Polycyclic Aromatic Compounds","volume":null,"pages":null},"PeriodicalIF":2.4,"publicationDate":"2024-02-13","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"139751542","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Recent Progress for the Synthesis of β-Carboline Derivatives – an Update 合成 β-咔啉衍生物的最新进展 - 综述
IF 2.4 3区 化学
Polycyclic Aromatic Compounds Pub Date : 2024-02-07 DOI: 10.1080/10406638.2023.2180525
Vidhi Patel , Tushar Bambharoliya , Drashti Shah , Yug Patel , Neel Savaliya , Yash Patel , Riddhisiddhi Patel , Vashisth Bhavsar , Harnisha Patel , Mehul Patel , Ashish Patel
{"title":"Recent Progress for the Synthesis of β-Carboline Derivatives – an Update","authors":"Vidhi Patel ,&nbsp;Tushar Bambharoliya ,&nbsp;Drashti Shah ,&nbsp;Yug Patel ,&nbsp;Neel Savaliya ,&nbsp;Yash Patel ,&nbsp;Riddhisiddhi Patel ,&nbsp;Vashisth Bhavsar ,&nbsp;Harnisha Patel ,&nbsp;Mehul Patel ,&nbsp;Ashish Patel","doi":"10.1080/10406638.2023.2180525","DOIUrl":"10.1080/10406638.2023.2180525","url":null,"abstract":"<div><p>The β-Carboline and its derivatives are privileged heterocyclic motifs and important building blocks in the field of medicinal chemistry due to their remarkable pharmacological potentialities and their derivatives have attracted a great deal of interest due to their wide range of biological activities. β-Carboline contains tricyclic pyrido[3,4-b]indole moiety in their structure. The growing potential inherent in them encourages many researchers to address the challenges of the synthesis of β-Carboline framework. As a result, many methodologies have been developed to synthesize this important class of compounds. The present review is mainly an attempt to present the research work reported in the recent scientific literature focusing on different synthetic methods of β-Carboline and related derivatives.</p></div>","PeriodicalId":20303,"journal":{"name":"Polycyclic Aromatic Compounds","volume":null,"pages":null},"PeriodicalIF":2.4,"publicationDate":"2024-02-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"89267946","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Triethylammonium Hydrogen Sulfate Ionic Liquid-Assisted Highly Efficient Synthesis of Bis(indoyl)methanes 三乙基硫酸氢铵离子液体辅助高效合成双(吲哚酰)甲烷
IF 2.4 3区 化学
Polycyclic Aromatic Compounds Pub Date : 2024-02-07 DOI: 10.1080/10406638.2023.2181829
Pankaj Teli , Nusrat Sahiba , Ayushi Sethiya , Jay Soni , Shikha Agarwal
{"title":"Triethylammonium Hydrogen Sulfate Ionic Liquid-Assisted Highly Efficient Synthesis of Bis(indoyl)methanes","authors":"Pankaj Teli ,&nbsp;Nusrat Sahiba ,&nbsp;Ayushi Sethiya ,&nbsp;Jay Soni ,&nbsp;Shikha Agarwal","doi":"10.1080/10406638.2023.2181829","DOIUrl":"10.1080/10406638.2023.2181829","url":null,"abstract":"<div><p>A highly efficient eco-benign pathway was developed for the synthesis of a library of 34 bis(indoyl)methane derivatives using triethylammonium hydrogen sulfate ionic liquid as a green catalyst in high to excellent yields (82–98%) at room temperature. The reaction was easy to execute by simply mixing two equivalents of indole with one equivalent of different aldehydes (including aromatic, heterocyclic, and aliphatic) using ionic liquid as a catalyst and water as a solvent under stirring at mild reaction environment. The current methodology has several benefits such as operational simplicity, short time period (25–60 min), cost-efficient, environment-friendly, easily recoverable catalyst, and highly reusable up to five cycles.</p></div>","PeriodicalId":20303,"journal":{"name":"Polycyclic Aromatic Compounds","volume":null,"pages":null},"PeriodicalIF":2.4,"publicationDate":"2024-02-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"75542120","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Ultrasound-Assisted Efficient Synthesis of Azomethine Derivatives of 1-Phenylimidazo[1,5-a]Pyridine 超声辅助高效合成 1-苯基咪唑并[1,5-a]吡啶的偶氮甲基衍生物
IF 2.4 3区 化学
Polycyclic Aromatic Compounds Pub Date : 2024-02-07 DOI: 10.1080/10406638.2023.2180527
Suhas G. Patil , Jagannath S. Jadhav , Hemant V. Chavan , Sagar T. Sankpal
{"title":"Ultrasound-Assisted Efficient Synthesis of Azomethine Derivatives of 1-Phenylimidazo[1,5-a]Pyridine","authors":"Suhas G. Patil ,&nbsp;Jagannath S. Jadhav ,&nbsp;Hemant V. Chavan ,&nbsp;Sagar T. Sankpal","doi":"10.1080/10406638.2023.2180527","DOIUrl":"10.1080/10406638.2023.2180527","url":null,"abstract":"<div><p>In the present research work, ultrasound-assisted synthesis of a series of novel azomethine derivatives of 1-phenylimidazo[1,5-a]pyridine has been achieved. The synthetic route involves the conversion of ethyl-1-phenylimidazo-[1,5-a]pyridine-3-carboxylate to 1-phenylimidazo[1,5-a]pyridine-3-carbohydrazide followed by nucleophilic addition-elimination reaction with diverse aromatic aldehydes. The developed clean and simple protocol offers a set of advantages such as mild reaction conditions, environment friendliness, and high atom economy apart from excellent yields (70–92%). All compounds were found to be stable in atmospheric conditions for a long period of time and were soluble in polar solvents.</p></div>","PeriodicalId":20303,"journal":{"name":"Polycyclic Aromatic Compounds","volume":null,"pages":null},"PeriodicalIF":2.4,"publicationDate":"2024-02-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"83156503","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
QSPR Modeling with Topological Indices of Some Potential Drugs against Cancer 利用拓扑指标建立一些潜在抗癌药物的 QSPR 模型
IF 2.4 3区 化学
Polycyclic Aromatic Compounds Pub Date : 2024-02-07 DOI: 10.1080/10406638.2023.2189270
K. Pattabiraman , S. Sudharsan , Murat Cancan
{"title":"QSPR Modeling with Topological Indices of Some Potential Drugs against Cancer","authors":"K. Pattabiraman ,&nbsp;S. Sudharsan ,&nbsp;Murat Cancan","doi":"10.1080/10406638.2023.2189270","DOIUrl":"10.1080/10406638.2023.2189270","url":null,"abstract":"<div><p>In Sri Lanka as well as the rest of the globe, cancer is the top cause of mortality. One of the key medicines in treating tumors is anticancer medications and delivery dendrimers. To prevent the formation of the rapid proliferation of cancer cells, several tests were carried out. Because of this, research on dendrimers and anti-cancer medications is crucial. Topological indices (TIs) are molecular descriptors numerical values corresponding to the physical characteristics of a molecule’s chemical structure. It costs money to determine a molecule’s physical characteristics in a lab since it takes a lot of materials, medications, and time. Therefore, the relevant information about molecules may be obtained by computing TIs. This study’s goals are to compute hitherto uncalculated eccentricity-based TIs for various anticancer structures and to use curvilinear regression models to forecast the physical characteristics of particular anticancer medications. These anticancer medications were given different TIs developed in this work, allowing the researchers to understand the physical, physicochemical, and chemical characteristics related to them. In addition comparative study of the novel indices with some well-known and mostly used indices in structure–property modeling and anticancer drugs in performed.</p></div>","PeriodicalId":20303,"journal":{"name":"Polycyclic Aromatic Compounds","volume":null,"pages":null},"PeriodicalIF":2.4,"publicationDate":"2024-02-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"86554472","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
Imidazole-Based Alkaloids from Marine Sponges (Leucetta and Clathrina) as Potential Inhibitors Targeting SARS-CoV-2 Main Protease: An In Silico Approach 来自海洋海绵（Leucetta 和 Clathrina）的咪唑类生物碱作为针对 SARS-CoV-2 主要蛋白酶的潜在抑制剂：硅学方法
IF 2.4 3区 化学
Polycyclic Aromatic Compounds Pub Date : 2024-02-07 DOI: 10.1080/10406638.2023.2182796
Peter Solo , M. Arockia doss
{"title":"Imidazole-Based Alkaloids from Marine Sponges (Leucetta and Clathrina) as Potential Inhibitors Targeting SARS-CoV-2 Main Protease: An In Silico Approach","authors":"Peter Solo ,&nbsp;M. Arockia doss","doi":"10.1080/10406638.2023.2182796","DOIUrl":"10.1080/10406638.2023.2182796","url":null,"abstract":"<div><p>Imidazole-based compounds form a prominent class of heterocyclic compounds, displaying diverse applications, especially with regards to its biological and pharmacological activities. Molecular docking, simulations, and drug-likeness prediction were performed on 45 imidazole-based alkaloids from two species of marine sponges (Leucetta and Clathrina). The study seeks to identify possible inhibitors of the SARS-CoV-2 Main Protease in an effort to battle the prevailing pandemic which has been caused by the widespread infections of the SAR-CoV-2 virus in its varied mutated forms. Computational analysis with MOE 2015.10 program reveals that, among the imidazole-based alkaloids, Naamidines have a high affinity for the target protein (PDB ID:6W63), even interacting with the catalytic dyad, as compared to its non-covalent inhibitor X77. Among all the top-scoring ligands, Naamidine H produced the highest binding score of −8.87078 kcal/mol. MD simulation studies with NAMD confirms the stability of the interactions of Naamidines with the target protein. MM-GBSA calculations were performed on the top binding ligands which further confirms the binding affinity of the top-scoring ligands. Computational and pharmacological investigations in this study proposes Naamidines, as effective inhibitors of Mpro. Naamidine I, Naamidine E, and Pyronaamidine could be potential anti-viral candidates against SAR-CoV-2.</p></div>","PeriodicalId":20303,"journal":{"name":"Polycyclic Aromatic Compounds","volume":null,"pages":null},"PeriodicalIF":2.4,"publicationDate":"2024-02-07","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"81114531","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
引用次数: 0
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