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首页> 外文期刊>Bioorganic and Medicinal Chemistry Letters >Synthesis, antimicrobial evaluation and QSAR studies of novel piperidin-4-yl-5-spiro-thiadiazoline derivatives.
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Synthesis, antimicrobial evaluation and QSAR studies of novel piperidin-4-yl-5-spiro-thiadiazoline derivatives.

机译:新的哌啶-4-基-5-螺-噻二唑啉衍生物的合成,抗菌评估和QSAR研究。

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摘要

In an attempt to find a new class of antimicrobial agents, a series of new 1,3,4-thiadiazolines were synthesized from 2,6-diarylpiperidin-4-ones, via the corresponding 4'-phenylthiosemicarbazones. All the synthesized compounds (23-39) were virtually screened against bacterial (Staphylococcus aureus, Escherichia coli, Pseudomonas aeruginosa and Salmonella typhi) and fungal strains (Candida albicans, Rhizopus sp, Aspergillus niger and Aspergillus flavus) by serial dilution method. QSAR study indicated that the increase in weakly polar component of solvent accessible surface area will favour antibacterial activity while increase in polarizability and decrease in ionisation potential and hydrogen bond donor will favour antifungal activity.
机译:为了找到一类新的抗微生物剂,通过2,6-二芳基哌啶-4-酮经相应的4′-苯基硫代半咪唑酮合成了一系列新的1,3,4-噻二唑啉。通过系列稀释法对所有合成的化合物(23-39)进行了细菌(金黄色葡萄球菌,大肠杆菌,铜绿假单胞菌和伤寒沙门氏菌)和真菌菌株(白色念珠菌,根霉属,黑曲霉和黄曲霉)的虚拟筛选。 QSAR研究表明,溶剂可及表面积中弱极性组分的增加将有利于抗菌活性,而极化性的增加和电离势的降低以及氢键供体的降低将有利于抗真菌活性。

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