Unveiling spectroscopic behaviour and molecular features (DFT studies) of Exemestane-maleic acid cocrystal as model multicomponent system

Journal of Molecular Structure, Journal Year: 2024, Volume and Issue: 1319, P. 139471 - 139471

Published: July 27, 2024

Language: Английский

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Structural and biological studies on beta – alanine substituted Sulfonamide derivatives: a new class of Juvenile hormone mimics as Insect growth regulators

Journal of Molecular Structure, Journal Year: 2024, Volume and Issue: unknown, P. 140046 - 140046

Published: Sept. 1, 2024

Language: Английский

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Synthesis, Molecular Docking, and Anticancer Screening of Ester‐based Thiazole Derivatives

Chemistry & Biodiversity, Journal Year: 2024, Volume and Issue: unknown

Published: Sept. 18, 2024

Abstract This study investigates the potential of five compounds as novel anticancer agents. We examined their efficacy, mechanisms action, and impact on various cancer cell lines, through a comprehensive set experiments. Notably, compound 3e demonstrated superior activity compared to positive control cisplatin, with GI 50 value 6.3±0.7 μM against breast line (MCF‐7). Compound 3b also displayed remarkable growth inhibition, yielding values 8.7±0.2 (MCF‐7) 8.9±0.5 colon (HCT‐116). Cell count experiments further confirmed potent inhibitory effects , 3c MCF‐7 HCT‐116 growth. reduction 55–60 % at complete inhibition (100 %) 2x . exhibited 50–55 (GI ) 90–95 (2x in cells. 75–80 35–40 In‐depth mechanistic investigations unveiled valuable insights into mode action The cell‐cycle assay G2/M phase arrest, DNA damage, caspase‐mediated apoptosis both Caspase activation indicated significant increase following exposure Furthermore, induced reactive oxygen species (ROS) production, influencing cells differently. Elevated ROS production distinct contribute deeper understanding cytotoxic Overall, these findings highlight investigated compounds, particularly effective inducers Mechanistic cycle apoptosis, modulation provide effects. offers contribution development promising agents therapeutic applications.

Language: Английский

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Rational designing of environmentally affable novel hole transporting materials through synergetic engineering of end-capped acceptors

Materials chemistry and physics., Journal Year: 2024, Volume and Issue: unknown, P. 100001 - 100001

Published: Oct. 1, 2024

Language: Английский

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Combining experiments to elucidate carbon dioxide absorption in amino acid-anion based ionic liquids at the molecular level

Journal of Molecular Liquids, Journal Year: 2024, Volume and Issue: unknown, P. 126342 - 126342

Published: Oct. 1, 2024

Language: Английский

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Vibrational spectroscopic characterization, quantum chemical, molecular docking and molecular dynamics investigations of cyclo(L-phenylalanyl-L-proline), an anticancer agent

Spectroscopy Letters, Journal Year: 2024, Volume and Issue: unknown, P. 1 - 19

Published: Nov. 25, 2024

Language: Английский

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Antibacterial activity and DNA interaction of triazine iron and ruthenium complexes: spectroscopic, voltammetric and theoretical studies

RSC Advances, Journal Year: 2023, Volume and Issue: 13(42), P. 29594 - 29606

Published: Jan. 1, 2023

Two complexes of [Ru(μ-tptz) 2 ]Cl and [Fe(μ-tptz) are synthesized, their DNA binding, molecular docking antibacterial activity investigated.

Language: Английский

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