{"title":"Drugs and Their Mode of Action: A Review on Sulfur-Containing Heterocyclic Compounds","authors":"Kanchan Kapoor, Navneet Kaur, Harvinder Singh Sohal, Manvinder Kaur, Kishanpal Singh, Asim Kumar","doi":"10.1080/10406638.2024.2392781","DOIUrl":"https://doi.org/10.1080/10406638.2024.2392781","url":null,"abstract":"Sulfur-containing heterocyclic compounds have emerged as an important class of bioactive molecules in drug discovery owing to their diverse pharmacological activities and unique modes of action. Su...","PeriodicalId":20303,"journal":{"name":"Polycyclic Aromatic Compounds","volume":"10 1","pages":""},"PeriodicalIF":2.4,"publicationDate":"2024-08-27","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142204208","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}
{"title":"Eco-Friendly One-Pot Synthesis of Tetrahydrobenzo[b]Pyran and Dihydropyrano[3,2-c]Chromene Derivatives Using Functionalized Fe3O4@SiO2@SO3H Under MWI","authors":"Raju Shekhanavar, Santosh Khatavi, Kantharaju Kamanna","doi":"10.1080/10406638.2024.2389939","DOIUrl":"https://doi.org/10.1080/10406638.2024.2389939","url":null,"abstract":"The present work describes a greener method of preparation of Fe3O4 nanoparticles, which are then functionalized to Fe3O4@SiO2@SO3H, and employed in the one-pot three-component synthesis of tetrahy...","PeriodicalId":20303,"journal":{"name":"Polycyclic Aromatic Compounds","volume":"17 1","pages":""},"PeriodicalIF":2.4,"publicationDate":"2024-08-23","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142204211","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}
El Hassane Anouar, Insaf Filali, Syed Adnan Ali Shah, Khalid Karrouchi
{"title":"Synthesis, Spectroscopic Characterization, DFT, Molecular Docking, Catechol Oxidase Activity, and Anti-SARS-CoV-2 of Acylhydrazone Derivatives","authors":"El Hassane Anouar, Insaf Filali, Syed Adnan Ali Shah, Khalid Karrouchi","doi":"10.1080/10406638.2024.2391486","DOIUrl":"https://doi.org/10.1080/10406638.2024.2391486","url":null,"abstract":"In the present work, five pyrazole-hydrazone biomolecule ligands (L1–L5) were synthesized by condensation between 1H-pyrazole-3-carbohydrazide (2) and aromatic benzaldehydes. Their corresponding st...","PeriodicalId":20303,"journal":{"name":"Polycyclic Aromatic Compounds","volume":"2 1","pages":""},"PeriodicalIF":2.4,"publicationDate":"2024-08-23","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142204209","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}
Hani Hamidi, Masoumeh Hosseinzadeh, Daryoush Zareyee, Mohammad A. Khalilzadeh
{"title":"Structural Elucidation of Some Flavonoids Isolated from Litsea costalis and Their Biological Evaluation","authors":"Hani Hamidi, Masoumeh Hosseinzadeh, Daryoush Zareyee, Mohammad A. Khalilzadeh","doi":"10.1080/10406638.2024.2393249","DOIUrl":"https://doi.org/10.1080/10406638.2024.2393249","url":null,"abstract":"Litsea costalis is a well-known medicinal plant in tropical and subtropical areas. Four significant flavonoids were extracted and characterized from the plant leaf extract. One component was discov...","PeriodicalId":20303,"journal":{"name":"Polycyclic Aromatic Compounds","volume":"46 1","pages":""},"PeriodicalIF":2.4,"publicationDate":"2024-08-21","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142204210","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}
{"title":"Antioxidants as Modulators of PAH Contaminants in Food and Living Organisms: An Overview Study","authors":"Parisa Sadighara","doi":"10.1080/10406638.2024.2390624","DOIUrl":"https://doi.org/10.1080/10406638.2024.2390624","url":null,"abstract":"Polycyclic aromatic hydrocarbons (PAHs) are a group of complex chemicals that are formed and released during incomplete combustion during industrial processes or pyrolysis of the organic matter. Hu...","PeriodicalId":20303,"journal":{"name":"Polycyclic Aromatic Compounds","volume":"15 1","pages":""},"PeriodicalIF":2.4,"publicationDate":"2024-08-19","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142252797","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}
Jeelan Basha Nagenahalli, Prashanth Reddiyappa, Akshay K Thammaiah
{"title":"Synthesis of Pharmacologically Potent Benzimidazole Analogs","authors":"Jeelan Basha Nagenahalli, Prashanth Reddiyappa, Akshay K Thammaiah","doi":"10.1080/10406638.2024.2387615","DOIUrl":"https://doi.org/10.1080/10406638.2024.2387615","url":null,"abstract":"Benzimidazole is one of the heterocycles associated with diverse biological potential such as anthelmintic, antacid, antimicrobial, anticancer, and antiviral. Based on the importance of this moiety...","PeriodicalId":20303,"journal":{"name":"Polycyclic Aromatic Compounds","volume":"26 1","pages":""},"PeriodicalIF":2.4,"publicationDate":"2024-08-13","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"142204212","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}
{"title":"Computing Degree-Based Topological Descriptors of Certain Tessellations of Kekulenes Using M-Polynomial and Neighborhood M-Polynomial","authors":"Pradeepa A., Arathi P.","doi":"10.1080/10406638.2024.2384901","DOIUrl":"https://doi.org/10.1080/10406638.2024.2384901","url":null,"abstract":"Topological indices are well-known molecular descriptors that may be applied to any graph and to model specific molecular structures, utilized for property correlation in quantitative structure act...","PeriodicalId":20303,"journal":{"name":"Polycyclic Aromatic Compounds","volume":"11 1","pages":""},"PeriodicalIF":2.4,"publicationDate":"2024-08-05","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141944759","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}
{"title":"Synthesis and Antimicrobial Evaluation of 1H-1,2,3-Triazole-Linked Quinoline-Phenolic Natural Product Conjugates","authors":"Paul Awolade, Pule Seboletswe, Parvesh Singh","doi":"10.1080/10406638.2024.2380996","DOIUrl":"https://doi.org/10.1080/10406638.2024.2380996","url":null,"abstract":"A new library of quinoline–natural product conjugates bearing 1,2,3-triazole moiety as a linker has been synthesized using the copper(I) catalyzed azide-alkyne [3 + 2] cycloaddition reaction (CuAAC...","PeriodicalId":20303,"journal":{"name":"Polycyclic Aromatic Compounds","volume":"81 1","pages":""},"PeriodicalIF":2.4,"publicationDate":"2024-07-22","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"141944758","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}
{"title":"Single Crystal XRD, Hirshfeld Surface, Quantum Chemical and Molecular Docking Studies on Diethyl1-(4-Nitrobenzyl)-4-(4-Nitrophenyl)-2,2-Dioxooctahydro-2-Pyrrolo[2,1-c]1,2Thiazine-1,3-Dicarboxylate: a Novel HIV-1Inhibitor","authors":"","doi":"10.1080/10406638.2023.2238864","DOIUrl":"10.1080/10406638.2023.2238864","url":null,"abstract":"<div><p>The single crystal of the title compound Diethyl 1-(4-nitrobenzyl)-4-(4-nitrophenyl)-2,2-dioxooctahydro-2-pyrrolo[2,1-<em>c</em>]<sup>1,4</sup>thiazine-1,3-dicarboxylate was grown and characterized by single crystal X-ray diffraction technique. Further, Hirshfeld surface, quantum chemical, and molecular docking analyses of the compound were carried out. The title compound was crystallized in a triclinic crystal system with a centrosymmetric space group of P-1 and has one molecule in the asymmetric unit. The stability of the grown crystal structure was confirmed by the C-H…O and π…π interactions. The hydrogen bonding features were analyzed and the prominent intermolecular interactions present in the structure were investigated using Hirshfeld surface analysis. The interaction energy between pairs of the molecule was obtained from Energy Framework analysis. The molecular structure of the title compound was optimized using density functional theory calculation in the ground state and the calculated structural parameters of the compound were compared with the experimental XRD data. Mulliken atomic charge distribution and frontier molecular orbitals analyses were also carried out to validate the reactivity of the title molecule. Molecular docking studies confirm that the title compound has potent inhibitory nature against the human mutant HIV-1 reverse transcriptase protein. Thus, the present study paves the way for the development of a novel HIV-1 drug.</p></div>","PeriodicalId":20303,"journal":{"name":"Polycyclic Aromatic Compounds","volume":"44 6","pages":"Pages 3719-3735"},"PeriodicalIF":2.4,"publicationDate":"2024-07-02","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"88751200","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}
{"title":"Ultrasound Promoted One-Pot Multicomponent Synthesis of Highly Functionalized Tetrahydropyridine Derivatives","authors":"","doi":"10.1080/10406638.2023.2242554","DOIUrl":"10.1080/10406638.2023.2242554","url":null,"abstract":"<div><p>The N-methyl pyridinium tosylate (NMPyTs) ionic liquid is used as an efficient, homogeneous, and recyclable catalyst for the synthesis of tetrahydropyridine derivatives via one-pot multi-component condensation of aromatic aldehyde, anilines, and <em>β</em>-ketoesters under ultrasonic irradiations. This protocol was successfully pertinent to a wide range of structurally diverse aromatic aldehydes, substituted anilines, and <em>β</em>-ketoesters. The major characteristics of this technique include operational simplicity, short reaction times, mild reaction conditions, and high yield. Importantly, NMPyTs can undergo up to three recycle runs without any noticeable loss of catalytic activity.</p></div>","PeriodicalId":20303,"journal":{"name":"Polycyclic Aromatic Compounds","volume":"44 6","pages":"Pages 3964-3974"},"PeriodicalIF":2.4,"publicationDate":"2024-07-02","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"90100004","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}