کد مقاله | کد نشریه | سال انتشار | مقاله انگلیسی | نسخه تمام متن |
---|---|---|---|---|
1408305 | 1501736 | 2015 | 11 صفحه PDF | دانلود رایگان |
عنوان انگلیسی مقاله ISI
Molecular characterization, biological activity, and in silico study of 2-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-6-methoxy-4H-chromen-4-one as a novel selective COX-2 inhibitor
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کلمات کلیدی
موضوعات مرتبط
مهندسی و علوم پایه
شیمی
شیمی آلی
پیش نمایش صفحه اول مقاله
چکیده انگلیسی
• We have successfully synthesized 2-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-6-methoxy-4H-chromen-4-one, 22.
• The structural characterization was performed by 1D and 2D NMR and single X-ray crystallographic analysis.
• The results presented provide understanding on the binding interactions between 22 and COX-2.
The present study aimed to characterize and investigate 2-(3,4-dimethoxyphenyl)-3-(4-fluorophenyl)-6-methoxy-4H-chromen-4-one (22) as a novel selective COX-2 inhibitor. The data collected from the single X-ray crystallographic analysis and in silico study provide important insights on the molecular conformation and the binding interactions that are responsible for the COX-2 selectivity.
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ناشر
Database: Elsevier - ScienceDirect (ساینس دایرکت)
Journal: Journal of Molecular Structure - Volume 1081, 5 February 2015, Pages 51–61
Journal: Journal of Molecular Structure - Volume 1081, 5 February 2015, Pages 51–61
نویسندگان
Kamal Rullah, Mohd Fadhlizil Fasihi Mohd Aluwi, Bohari M. Yamin, Mohd Syukri Baharuddin, Nor Hadiani Ismail, Hilwan Yuda Teruna, Syed Nasir Abbas Bukhari, Ibrahim Jantan, Juriyati Jalil, Khairana Husain, Lam Kok Wai,