Vivek Pathania, Navya Grover, Shashi Kiran Vermani, B. K. Vermani, Shrutila Sharma, Harpreet Kaur
{"title":"不同温度下 H-1 型抗组胺药物氯苯那敏 (CP) 在水以及尿素、葡萄糖和氯化钠水溶液中的分子相互作用研究","authors":"Vivek Pathania, Navya Grover, Shashi Kiran Vermani, B. K. Vermani, Shrutila Sharma, Harpreet Kaur","doi":"10.1007/s10953-023-01338-4","DOIUrl":null,"url":null,"abstract":"<div><p>The intermolecular interactions and solution properties of the antihistamine drug chlorpheniramine (CP) in aqueous, aqueous solutions of electrolyte and non-electrolyte have been examined in the current work using volumetric and spectroscopic approaches to investigate how the drug is affected by co-solutes. Also, a drug’s behavior in water and other aqueous systems can be studied to learn more about the chemistry of biological systems. Using an Anton Paar density and sound velocity meter, densities and sound velocities for CP (0–0.10 mol⋅kg<sup>−1</sup>) at various temperatures (298.15, 308.15, and 318.15 K) in water and in aqueous 0.05 mol⋅kg<sup>−1</sup> urea, glucose, and sodium chloride have been measured to determine apparent molar properties: apparent molar volume (<span>\\(V_{\\phi} )\\)</span> and apparent molar compressibility <span>\\((K_{\\phi, {\\mathrm{S}}})\\)</span>. A number of derived parameters, including limiting apparent molar volume <span>\\(\\left( {V_{\\phi }^{0} } \\right)\\)</span>, limiting apparent molar compressibility (<span>\\(K_{\\phi, {\\mathrm{S}}}^{0})\\)</span>, limiting apparent molar expansibility (<span>\\(\\phi_{\\mathrm{E}}^{0} )\\)</span>, and isobaric thermal expansion coefficient (<i>ɑ</i>) were obtained using the data on apparent molar properties. While analyzing the data, solute–solvent interactions are taken into account, as well as their considerable effects on CP hydration when co-solutes, are introduced to the combination. The negative transfer properties suggest the predominance of ion-hydrophobic and hydrophobic-hydrophobic interactions in all the studied systems. Positive and small negative values of Hepler’s constant revealed the structure-making capability of CP in aqueous urea, glucose, and sodium chloride. Also, an IR study has been done to verify the results obtained from volumetric and compressibility data. Understanding how drugs behave in various solvent systems during drug development is made easier by understanding drug interactions.</p></div>","PeriodicalId":1,"journal":{"name":"Accounts of Chemical Research","volume":null,"pages":null},"PeriodicalIF":16.4000,"publicationDate":"2023-12-14","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Study of Molecular Interactions of the H-1 Antihistamine Drug Chlorpheniramine (CP) in Water and in Aqueous Solutions of Urea, Glucose, and Sodium Chloride at Different Temperatures\",\"authors\":\"Vivek Pathania, Navya Grover, Shashi Kiran Vermani, B. K. Vermani, Shrutila Sharma, Harpreet Kaur\",\"doi\":\"10.1007/s10953-023-01338-4\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"<div><p>The intermolecular interactions and solution properties of the antihistamine drug chlorpheniramine (CP) in aqueous, aqueous solutions of electrolyte and non-electrolyte have been examined in the current work using volumetric and spectroscopic approaches to investigate how the drug is affected by co-solutes. Also, a drug’s behavior in water and other aqueous systems can be studied to learn more about the chemistry of biological systems. Using an Anton Paar density and sound velocity meter, densities and sound velocities for CP (0–0.10 mol⋅kg<sup>−1</sup>) at various temperatures (298.15, 308.15, and 318.15 K) in water and in aqueous 0.05 mol⋅kg<sup>−1</sup> urea, glucose, and sodium chloride have been measured to determine apparent molar properties: apparent molar volume (<span>\\\\(V_{\\\\phi} )\\\\)</span> and apparent molar compressibility <span>\\\\((K_{\\\\phi, {\\\\mathrm{S}}})\\\\)</span>. A number of derived parameters, including limiting apparent molar volume <span>\\\\(\\\\left( {V_{\\\\phi }^{0} } \\\\right)\\\\)</span>, limiting apparent molar compressibility (<span>\\\\(K_{\\\\phi, {\\\\mathrm{S}}}^{0})\\\\)</span>, limiting apparent molar expansibility (<span>\\\\(\\\\phi_{\\\\mathrm{E}}^{0} )\\\\)</span>, and isobaric thermal expansion coefficient (<i>ɑ</i>) were obtained using the data on apparent molar properties. While analyzing the data, solute–solvent interactions are taken into account, as well as their considerable effects on CP hydration when co-solutes, are introduced to the combination. The negative transfer properties suggest the predominance of ion-hydrophobic and hydrophobic-hydrophobic interactions in all the studied systems. Positive and small negative values of Hepler’s constant revealed the structure-making capability of CP in aqueous urea, glucose, and sodium chloride. Also, an IR study has been done to verify the results obtained from volumetric and compressibility data. Understanding how drugs behave in various solvent systems during drug development is made easier by understanding drug interactions.</p></div>\",\"PeriodicalId\":1,\"journal\":{\"name\":\"Accounts of Chemical Research\",\"volume\":null,\"pages\":null},\"PeriodicalIF\":16.4000,\"publicationDate\":\"2023-12-14\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Accounts of Chemical Research\",\"FirstCategoryId\":\"92\",\"ListUrlMain\":\"https://link.springer.com/article/10.1007/s10953-023-01338-4\",\"RegionNum\":1,\"RegionCategory\":\"化学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q1\",\"JCRName\":\"CHEMISTRY, MULTIDISCIPLINARY\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Accounts of Chemical Research","FirstCategoryId":"92","ListUrlMain":"https://link.springer.com/article/10.1007/s10953-023-01338-4","RegionNum":1,"RegionCategory":"化学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q1","JCRName":"CHEMISTRY, MULTIDISCIPLINARY","Score":null,"Total":0}
Study of Molecular Interactions of the H-1 Antihistamine Drug Chlorpheniramine (CP) in Water and in Aqueous Solutions of Urea, Glucose, and Sodium Chloride at Different Temperatures
The intermolecular interactions and solution properties of the antihistamine drug chlorpheniramine (CP) in aqueous, aqueous solutions of electrolyte and non-electrolyte have been examined in the current work using volumetric and spectroscopic approaches to investigate how the drug is affected by co-solutes. Also, a drug’s behavior in water and other aqueous systems can be studied to learn more about the chemistry of biological systems. Using an Anton Paar density and sound velocity meter, densities and sound velocities for CP (0–0.10 mol⋅kg−1) at various temperatures (298.15, 308.15, and 318.15 K) in water and in aqueous 0.05 mol⋅kg−1 urea, glucose, and sodium chloride have been measured to determine apparent molar properties: apparent molar volume (\(V_{\phi} )\) and apparent molar compressibility \((K_{\phi, {\mathrm{S}}})\). A number of derived parameters, including limiting apparent molar volume \(\left( {V_{\phi }^{0} } \right)\), limiting apparent molar compressibility (\(K_{\phi, {\mathrm{S}}}^{0})\), limiting apparent molar expansibility (\(\phi_{\mathrm{E}}^{0} )\), and isobaric thermal expansion coefficient (ɑ) were obtained using the data on apparent molar properties. While analyzing the data, solute–solvent interactions are taken into account, as well as their considerable effects on CP hydration when co-solutes, are introduced to the combination. The negative transfer properties suggest the predominance of ion-hydrophobic and hydrophobic-hydrophobic interactions in all the studied systems. Positive and small negative values of Hepler’s constant revealed the structure-making capability of CP in aqueous urea, glucose, and sodium chloride. Also, an IR study has been done to verify the results obtained from volumetric and compressibility data. Understanding how drugs behave in various solvent systems during drug development is made easier by understanding drug interactions.
期刊介绍:
Accounts of Chemical Research presents short, concise and critical articles offering easy-to-read overviews of basic research and applications in all areas of chemistry and biochemistry. These short reviews focus on research from the author’s own laboratory and are designed to teach the reader about a research project. In addition, Accounts of Chemical Research publishes commentaries that give an informed opinion on a current research problem. Special Issues online are devoted to a single topic of unusual activity and significance.
Accounts of Chemical Research replaces the traditional article abstract with an article "Conspectus." These entries synopsize the research affording the reader a closer look at the content and significance of an article. Through this provision of a more detailed description of the article contents, the Conspectus enhances the article's discoverability by search engines and the exposure for the research.