Synthesis, characterization, biological activity, DFT, molecular docking and ADME studies of metal (II) complexes of a bidentate Schiff’s base (E)-4-chloro-2-((2-hydroxy-3-methoxybenzylidene)amino)benzoic acid

Journal of Dispersion Science and Technology, Journal Year: 2025, Volume and Issue: unknown, P. 1 - 14

Published: Feb. 11, 2025

Language: Английский

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Synergistic Exploration of Thiazole Derivatives: Synthesis, Antimicrobial Activity and Computational Insights

Journal of Molecular Structure, Journal Year: 2025, Volume and Issue: unknown, P. 141772 - 141772

Published: Feb. 1, 2025

Language: Английский

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Comprehensive Analysis of Hydrazone Schiff Bases: Synthesis, Structural Characterization, DFT Studies, Molecular Docking Insights and Bioactivity Assessment

Journal of Molecular Structure, Journal Year: 2025, Volume and Issue: unknown, P. 141905 - 141905

Published: March 1, 2025

Language: Английский

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Synthesis, antioxidant activity, DFT simulations, molecular docking studies of Schiff base derivatives containing 2-(2-hydrazinyl) thiazole moiety

Journal of Molecular Structure, Journal Year: 2025, Volume and Issue: unknown, P. 142150 - 142150

Published: March 1, 2025

Language: Английский

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Recent advances in Schiff bases and Cu(II) complexes: Applications in fluorescence imaging and anticancer therapy (2020–2024)

Journal of Inorganic Biochemistry, Journal Year: 2025, Volume and Issue: 268, P. 112909 - 112909

Published: April 5, 2025

Language: Английский

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Crystal Structure of 4-(4-Fluorophenyl)-1,3-thiazole-2-amine in dimeric form: Green synthesis, DFT, HS analysis, Anticandidal and Anticancer study.

Journal of Molecular Structure, Journal Year: 2025, Volume and Issue: unknown, P. 142483 - 142483

Published: April 1, 2025

Language: Английский

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Structure Elucidation and Computational Studies of the Thiazole Derivative Against SARS-CoV-2 Virus: Insights from XRD, DFT, Molecular Docking, and Molecular Dynamics Simulation

Journal of Molecular Structure, Journal Year: 2024, Volume and Issue: 1322, P. 140550 - 140550

Published: Oct. 31, 2024

Language: Английский

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DNA and bovine serum albumin protein (BSA) interaction of antitumor supramolecular nickel(II) complex: Inference for drug design

Journal of Industrial and Engineering Chemistry, Journal Year: 2024, Volume and Issue: 140, P. 225 - 236

Published: May 21, 2024

Language: Английский

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Microwave‐Assisted Synthesis of Novel Co(II), Cu(II), and Zn(II) Complexes Derived From Fluorinated Thiazole Schiff Bases: Antimicrobial, Anticancer, and Molecular Docking Study

Applied Organometallic Chemistry, Journal Year: 2024, Volume and Issue: unknown

Published: Nov. 21, 2024

ABSTRACT Six new complexes of Co(II), Cu(II), and Zn(II) metal were synthesized by microwave‐assisted green method from fluorinated Schiff base ligands. The ligands prepared the condensation reaction 4‐(p‐fluorophenyl)‐5‐methyl‐2‐aminothiazole with 4‐methylsalicyldehyde (L1H) 4‐methoxysalicyldehyde (L2H). FT‐IR, NMR, HR‐MS spectral data confirm tridentate nature in Co(II) bidentate Cu(II) complexes. elemental analysis TGA study revealed 1:2 (M:L) stoichiometry all Electronic absorption, magnetic susceptibility, XRD express geometry crystal systems antimicrobial anticancer their achieved. results indicate that L2H have greater potency against Gram‐positive bacteria. In contrast, L1H exhibited zone inhibition Gram‐negative fungal strains. Furthermore, among complexes, complex ligand was found to exhibit potent activity IC 50 values 16.18 11.10 μM MDA‐MB‐231 A549 cell lines compared other parent Molecular docking EGFR (PDB: 5XGM) shows strong binding interactions good free energy support experimental results.

Language: Английский

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Novel Co(Ii), Cu(Ii) and Zn(Ii) Complexes Derived from Schiff Base Ligands Containing 4,5-Disubstituted Thiazole: Green Synthesis, Antimicrobial, Anti-Cancer and Molecular Docking Study

Published: Jan. 1, 2024

Language: Английский

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