Design, synthesis and docking studies of new quinoline-3-carbohydrazide derivatives as antitubercular agents

K. D. Thomas; Airody Vasudeva Adhikari; Sandeep Telkar; Imran H. Chowdhury; Riaz Mahmood; Nishith K. Pal; Guru Row; E. Sumesh

doi:10.1016/j.ejmech.2011.07.033

Design, synthesis and docking studies of new quinoline-3-carbohydrazide derivatives as antitubercular agents

K. D. Thomas, Airody Vasudeva Adhikari, Sandeep Telkar, Imran H. Chowdhury, Riaz Mahmood, Nishith K. Pal, Guru Row, E. Sumesh

Research output: Contribution to journal › Article › peer-review

104 Scopus citations

Abstract

Three new series of 4-hydroxy-8-trifluoromethyl-quinoline derivatives were synthesized through multi step reactions. All the newly synthesized compounds were characterized by spectral and elemental analyses. The structure of 5j was evidenced by X-ray crystallographic study. The newly synthesized title compounds were evaluated for their antimicrobial activities including antimycobacterial activity. Amongst the tested compounds, 5b, 5e, 5h, 5j, 6c and 7c displayed promising antimicrobial activity. The mode of action of these active compounds was carried out by docking of receptor enoyl-ACP reductase with newly synthesized candidate ligands, 5b, 5e, 5h, 5j and 6c.

Original language	English (US)
Pages (from-to)	5283-5292
Number of pages	10
Journal	European journal of medicinal chemistry
Volume	46
Issue number	11
DOIs	https://doi.org/10.1016/j.ejmech.2011.07.033
State	Published - Nov 2011
Externally published	Yes

Keywords

Antibacterial
Antimycobacterial
Docking study
Quinoline
X-ray crystallography

ASJC Scopus subject areas

Pharmacology
Drug Discovery
Organic Chemistry

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10.1016/j.ejmech.2011.07.033

Cite this

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title = "Design, synthesis and docking studies of new quinoline-3-carbohydrazide derivatives as antitubercular agents",

abstract = "Three new series of 4-hydroxy-8-trifluoromethyl-quinoline derivatives were synthesized through multi step reactions. All the newly synthesized compounds were characterized by spectral and elemental analyses. The structure of 5j was evidenced by X-ray crystallographic study. The newly synthesized title compounds were evaluated for their antimicrobial activities including antimycobacterial activity. Amongst the tested compounds, 5b, 5e, 5h, 5j, 6c and 7c displayed promising antimicrobial activity. The mode of action of these active compounds was carried out by docking of receptor enoyl-ACP reductase with newly synthesized candidate ligands, 5b, 5e, 5h, 5j and 6c.",

keywords = "Antibacterial, Antimycobacterial, Docking study, Quinoline, X-ray crystallography",

author = "Thomas, {K. D.} and Adhikari, {Airody Vasudeva} and Sandeep Telkar and Chowdhury, {Imran H.} and Riaz Mahmood and Pal, {Nishith K.} and Guru Row and E. Sumesh",

year = "2011",

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doi = "10.1016/j.ejmech.2011.07.033",

language = "English (US)",

volume = "46",

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journal = "European journal of medicinal chemistry",

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T1 - Design, synthesis and docking studies of new quinoline-3-carbohydrazide derivatives as antitubercular agents

AU - Thomas, K. D.

AU - Adhikari, Airody Vasudeva

AU - Telkar, Sandeep

AU - Chowdhury, Imran H.

AU - Mahmood, Riaz

AU - Pal, Nishith K.

AU - Row, Guru

AU - Sumesh, E.

PY - 2011/11

Y1 - 2011/11

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AB - Three new series of 4-hydroxy-8-trifluoromethyl-quinoline derivatives were synthesized through multi step reactions. All the newly synthesized compounds were characterized by spectral and elemental analyses. The structure of 5j was evidenced by X-ray crystallographic study. The newly synthesized title compounds were evaluated for their antimicrobial activities including antimycobacterial activity. Amongst the tested compounds, 5b, 5e, 5h, 5j, 6c and 7c displayed promising antimicrobial activity. The mode of action of these active compounds was carried out by docking of receptor enoyl-ACP reductase with newly synthesized candidate ligands, 5b, 5e, 5h, 5j and 6c.

KW - Antibacterial

KW - Antimycobacterial

KW - Docking study

KW - Quinoline

KW - X-ray crystallography

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Design, synthesis and docking studies of new quinoline-3-carbohydrazide derivatives as antitubercular agents

Abstract

Keywords

ASJC Scopus subject areas

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