Heterocycles 51: Liphophilicity investigation of some thiazole chalcones and aurones by experimental and theoretical methods. Issue 14 (25th May 2020)

• Record Type: Journal Article
• Authors: Coman, Fana‐Maria; Leonte, Denisa; Toma, Alexandra; Casoni, Dorina; Vlase, Laurian; Zaharia, Valentin
• Is Part Of: Journal of separation science. Volume 43:Issue 14(2020)
• Page Start: 2784
• Page End: 2793
• Publication Date: 2020-05-25
• Subjects: aurones -- chalcones -- chromatography -- computed logP -- lipophilicity; Separation (Technology) -- Periodicals; Chromatographic analysis -- Periodicals; 543.089
• DOI: 10.1002/jssc.202000262
• Languages: English
• ISSNs: 1615-9306

Abstract

Abstract: Reversed‐phase thin‐layer chromatography and reversed‐phase high‐performance liquid chromatography were used for lipophilicity determination of a library of 30 thiazole chalcones and aurones previously synthetized in our laboratory. The experimental lipophilicity data have been compared with theoretical lipophilicity parameters estimated by various computational methods. Good correlations between the experimental and calculated lipophilicity parameters have been found for both investigated classes of compounds. Correlations between the lipophilicity of the thiazole chalcones and aurones and their antiproliferative activity were discussed. The methodologies and data gathered in this study will contribute to the lipophilicity studies of chalcones and aurones derivatives, two important classes of compounds in medicinal chemistry.