CuAAC Mediated Synthesis of 2‐HBT Linked Bioactive 1,2,3‐Triazole Hybrids: Investigations through Fluorescence, DNA Binding, Molecular Docking, ADME Predictions and DFT Study DOI
Nidhi Nehra, Ram Kumar Tittal, Vikas D. Ghule

et al.

ChemistrySelect, Journal Year: 2021, Volume and Issue: 6(4), P. 685 - 694

Published: Jan. 25, 2021

Abstract A series of three different classes benzothiazole linked 1,2,3‐triazole hybrid molecules with varying alkyl spacers (ethyl, propyl, and butyl) between 2‐hydroxyphenyl benzothiazoles 1,2,3‐triazoles are efficiently synthesized under CuAAC condition. All compounds satisfactorily characterized by FTIR, 1 H‐NMR, 13 C‐NMR, ESI‐MS data structures some were finally supported single‐crystal X‐ray diffraction data. Most the exhibited good to better DNA binding property (0.28×10 5 M −1 2.91×10 ) well drug‐like properties. Some promising showed agreement all experimental theoretical computed properties (fluorescence study, binding, molecular docking, DFT, ADME Predictions).

Language: Английский

Design, Synthesis, and Antimicrobial Evaluation of Novel 5-Chloropyridine Oxalamide Conjugates as In Vitro and In Silico Inhibitors of E. coli DNA Gyrase and C. albicans Sterol 14α-Demethylase (CYP51) DOI
Dilip C. Kanjariya, Hem N. Naik, Meet J. Sherashiya

et al.

Russian Journal of Bioorganic Chemistry, Journal Year: 2025, Volume and Issue: 51(2), P. 827 - 849

Published: April 1, 2025

Language: Английский

Citations

0
Synthesis, Antimicrobial Activity, Molecular Docking and DFT Study: Aryl‐Carbamic Acid 1‐Benzyl‐1H‐[1,2,3]Triazol‐4‐ylmethyl Esters DOI

Naveen Naveen,

Ram Kumar Tittal,

Ghule D. Vikas

et al.

ChemistrySelect, Journal Year: 2020, Volume and Issue: 5(22), P. 6723 - 6729

Published: June 12, 2020

Abstract Bioactive carbamate‐1,4‐disubstituted 1,2,3‐triazole hybrid molecules were synthesized and characterized in high yield from carbamate‐linked terminal alkynes situ generated azides using Cell‐CuI‐NPs as heterogeneous catalysts via CuAAC reaction. The compound 8 demonstrated better antibacterial activity with MIC: 0.0077 μmol mL −1 for each bacterial strain E. coli , S. epidermidis B. subtilis compared to reference drug Norfloxacin (MIC: 0.0098 ). Also, the antifungal of fungal C. albicans was found superior among all compounds even than Fluconazole 0.0102 . biological results supported by molecular docking well DFT study.

Language: Английский

Citations

28
Synthesis, Characterization and Nanoformulation of Novel Sulfonamide-1,2,3-triazole Molecular Conjugates as Potent Antiparasitic Agents DOI Open Access
Faizah S. Aljohani, Nadjet Rezki, Mohamed Reda Aouad

et al.

International Journal of Molecular Sciences, Journal Year: 2022, Volume and Issue: 23(8), P. 4241 - 4241

Published: April 11, 2022

Toxoplasma gondii (T. gondii) is a highly prevalent parasite that has no gold standard treatment due to the poor action or numerous side effects. Focused sulfonamide-1,2,3-triazole hybrids 3a-c were wisely designed and synthesized via copper catalyzed 1,3-dipolar cycloaddition approach between prop-2-yn-1-alcohol 1 sulfa drug azides 2a-c. The newly click products fully characterized using different spectroscopic experiments loaded onto chitosan nanoparticles form novel nanoformulations for further anti-Toxoplasma investigation. current study proved effectiveness of all examined compounds in experimentally infected mice. Relative sulfadiazine, (3c) nanoformulae demonstrated most promising result toxoplasmosis as it resulted 100% survival, reduction along with remarkable histopathological improvement studied organs.

Language: Английский

Citations

18
Quinoline-1,2,3-triazole hybrids: Design, synthesis, antimalarial and antimicrobial evaluation DOI
Jyoti Yadav, C. P. Kaushik

Journal of Molecular Structure, Journal Year: 2024, Volume and Issue: 1316, P. 138882 - 138882

Published: June 20, 2024

Language: Английский

Citations

3
CuAAC Mediated Synthesis of 2‐HBT Linked Bioactive 1,2,3‐Triazole Hybrids: Investigations through Fluorescence, DNA Binding, Molecular Docking, ADME Predictions and DFT Study DOI
Nidhi Nehra, Ram Kumar Tittal, Vikas D. Ghule

et al.

ChemistrySelect, Journal Year: 2021, Volume and Issue: 6(4), P. 685 - 694

Published: Jan. 25, 2021

Abstract A series of three different classes benzothiazole linked 1,2,3‐triazole hybrid molecules with varying alkyl spacers (ethyl, propyl, and butyl) between 2‐hydroxyphenyl benzothiazoles 1,2,3‐triazoles are efficiently synthesized under CuAAC condition. All compounds satisfactorily characterized by FTIR, 1 H‐NMR, 13 C‐NMR, ESI‐MS data structures some were finally supported single‐crystal X‐ray diffraction data. Most the exhibited good to better DNA binding property (0.28×10 5 M −1 2.91×10 ) well drug‐like properties. Some promising showed agreement all experimental theoretical computed properties (fluorescence study, binding, molecular docking, DFT, ADME Predictions).

Language: Английский

Citations

20