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4‐Methyl morpholinium bis‐(thio)barbiturates: Synthesis, structure, anticancer evaluation, and CoMFA study
Journal of the Chinese Chemical Society ( IF 1.8 ) Pub Date : 2020-09-02 , DOI: 10.1002/jccs.202000057
Nader Noroozi Pesyan 1 , Hamid Rashidnejad 1 , Mohammad Ali Esmaeili 2 , Elnaz Safari 1 , Tuncay Tunç 3 , Mostafa Alilou 4 , Reihaneh Safavi‐Sohi 5 , Ertan Şahin 6
Affiliation  

The reaction of symmetrical (thio)barbituric acids with aldehydes in the presence of 4‐methyl morpholine yielded a new form of 4‐methyl morpholinium bis‐(thio)barbiturate containing charge‐separated intermolecular and eight‐membered intramolecular H‐bonds. X‐ray Crystallography, FT‐IR, and 1H and 13C‐NMR spectroscopy techniques were used for structure characterizations. Some of these compounds showed potent anticancer activities. Cytotoxicity of the synthetic compounds against HeLa and MCF‐7 cell lines were performed by MTT assay. In addition, a comparative molecular field analysis was carried out, and the effects of substituents on the biological activities of these compounds were explained.

中文翻译:

4-甲基吗啉双(硫代)巴比妥酸酯:合成,结构,抗癌评估和CoMFA研究

的对称的(硫代)巴比土酸在4-甲基吗啉存在下的醛反应得到的一种新形式的4-甲基吗啉双- (硫代)巴比妥类含电荷分离分子间和八元分子内ħ -键。X射线晶体学,FT-IR,1 H和13 C-NMR光谱技术用于结构表征。这些化合物中的一些显示出有效的抗癌活性。合成化合物对HeLa和MCF-7细胞系的细胞毒性通过MTT分析进行。另外,进行了比较分子场分析,并解释了取代基对这些化合物的生物活性的影响。
更新日期:2020-09-24
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