Design, Synthesis and Docking Studies of a Novel Ciprofloxacin Analogue as an Antimicrobial AGENT

The carboxylic acid group of ciprofloxacin was modified and amino mercapto triazole was substituted. The compound was confirmed by physical parameters (solubility, melting point), chromatographic methods (TLC) and consistent with its IR & 1HNMR spectra. The synthesized analogue was screened for...

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Main Authors: S. Jubie, R. Kalirajan, Pavankumar Yadav
Format: Article
Language:English
Published: Wiley 2012-01-01
Series:E-Journal of Chemistry
Online Access:http://dx.doi.org/10.1155/2012/340451
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author S. Jubie
R. Kalirajan
Pavankumar Yadav
author_facet S. Jubie
R. Kalirajan
Pavankumar Yadav
author_sort S. Jubie
collection DOAJ
description The carboxylic acid group of ciprofloxacin was modified and amino mercapto triazole was substituted. The compound was confirmed by physical parameters (solubility, melting point), chromatographic methods (TLC) and consistent with its IR & 1HNMR spectra. The synthesized analogue was screened for antibacterial activity against one gram positive & two gram negative species. The compound exhibited good antibacterial effect towards gram negative species when compared to the standard ciprofloxacin. At the same time the analogue was retaining antibacterial activity towards gram positive species when compared to standard ciprofloxacin. The molecular docking studies showed a good correlation between their antibacterial activity and autodock binding free energy.
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institution Kabale University
issn 0973-4945
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record_format Article
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spelling doaj-art-df824ae97b8445ae854bb7ce40e6a7d12025-08-20T03:26:22ZengWileyE-Journal of Chemistry0973-49452090-98102012-01-019298098710.1155/2012/340451Design, Synthesis and Docking Studies of a Novel Ciprofloxacin Analogue as an Antimicrobial AGENTS. Jubie0R. Kalirajan1Pavankumar Yadav2Department of Pharmaceutical Chemistry, J.S.S. College of Pharmacy, off campus - JSS University, Mysore, IndiaDepartment of Pharmaceutical Chemistry, J.S.S. College of Pharmacy, off campus - JSS University, Mysore, IndiaDepartment of Pharmaceutical Chemistry, J.S.S. College of Pharmacy, off campus - JSS University, Mysore, IndiaThe carboxylic acid group of ciprofloxacin was modified and amino mercapto triazole was substituted. The compound was confirmed by physical parameters (solubility, melting point), chromatographic methods (TLC) and consistent with its IR & 1HNMR spectra. The synthesized analogue was screened for antibacterial activity against one gram positive & two gram negative species. The compound exhibited good antibacterial effect towards gram negative species when compared to the standard ciprofloxacin. At the same time the analogue was retaining antibacterial activity towards gram positive species when compared to standard ciprofloxacin. The molecular docking studies showed a good correlation between their antibacterial activity and autodock binding free energy.http://dx.doi.org/10.1155/2012/340451
spellingShingle S. Jubie
R. Kalirajan
Pavankumar Yadav
Design, Synthesis and Docking Studies of a Novel Ciprofloxacin Analogue as an Antimicrobial AGENT
E-Journal of Chemistry
title Design, Synthesis and Docking Studies of a Novel Ciprofloxacin Analogue as an Antimicrobial AGENT
title_full Design, Synthesis and Docking Studies of a Novel Ciprofloxacin Analogue as an Antimicrobial AGENT
title_fullStr Design, Synthesis and Docking Studies of a Novel Ciprofloxacin Analogue as an Antimicrobial AGENT
title_full_unstemmed Design, Synthesis and Docking Studies of a Novel Ciprofloxacin Analogue as an Antimicrobial AGENT
title_short Design, Synthesis and Docking Studies of a Novel Ciprofloxacin Analogue as an Antimicrobial AGENT
title_sort design synthesis and docking studies of a novel ciprofloxacin analogue as an antimicrobial agent
url http://dx.doi.org/10.1155/2012/340451
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AT pavankumaryadav designsynthesisanddockingstudiesofanovelciprofloxacinanalogueasanantimicrobialagent