An Experimental Study to Biological Activity and Synthesis; and Theoretical Study for MEP, HOMO/LUMO Analysis and Molecular Docking of N-(۲-pyridyl)-para-styrene Sulfonamides

A combined experimental and theoretical investigation has been reported on N-(۲-pyridyl)-para-styrene sulfonamide (abbreviated as PSS). This compound synthesized from the reaction of para-styrene sulfonyl chloride and ۲- amino pyridine. The PSS was confirmed using FT-IR, ۱H-NMR spectroscopy. MEP and HOMO-LUMO analysis of the PSS have been investigated using DFT method. The PSS is investigated against Staphylococcus aureus and Escherichia coli. Molecular Docking study is also reported.

Keywords:

N-(pyridyl)-para styrene sulfonamide , DNA , BSA , MEP , HOMO and LUMO analysis

Authors

Parvaneh Shafieyoon

Department of Chemistry, Faculty of Science, Lorestan University, Khoramabad

Ebrahim Mehdipour

Department of Chemistry Faculty of Science Lorestan University, ۶۸۱۳۷-۱۷۱۳۳ Khorramabad Iran

Hosien Tavakol

Department of Chemistry, Isfahan University of Technology

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شناسه ملی سند علمی:

JR_ORGC-5-1_004

تاریخ نمایه سازی: 3 مهر 1402

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Shafieyoon, Parvaneh and Mehdipour, Ebrahim and Tavakol, Hosien,1398,An Experimental Study to Biological Activity and Synthesis; and Theoretical Study for MEP, HOMO/LUMO Analysis and Molecular Docking of N-(۲-pyridyl)-para-styrene Sulfonamides,https://civilica.com/doc/1766211

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Paper count: 10,447

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