Tailoring of novel water soluble Pd(II), Cu(II), Fe(III) and VO(II) chelates based on 4-[(5-bromo-2-hydroxy-benzylidene)-amino]-benzenesulfonate ligand: Synthesis, spectral investigations, DNA interaction and pharmaceutical applications supported by molecular docking approach

Journal of Molecular Structure, Год журнала: 2025, Номер unknown, С. 141780 - 141780

Опубликована: Фев. 1, 2025

Язык: Английский

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Development of Some Novel Hydrophilic Schiff Base Complexes: Synthesis, Spectroscopic Characterization, and DFT Calculation DNA‐Binding and Biomedical Studies Supported by Molecular Docking Approach

Applied Organometallic Chemistry, Год журнала: 2025, Номер 39(3)

Опубликована: Фев. 25, 2025

ABSTRACT Several unique transition metal chelates of ESSA = sodium;4‐[(3‐ethoxy‐2‐hydroxy‐benzylidene)‐amino]‐benzenesulfonate and its Cu(II), Fe(III), VO(II), Pd(II) were developed. Various spectral physicochemical experiments carried out to ascertain the geometrical form compounds under exploration. Spectrum info imine azomethine ligand was employed for clarification alterations structure triggered by complex formation. The formation complexes deploying continuous variation molar ratio explored, findings coincided with those observed in solid compounds, a (M:L) being (1:2) all complexes, except is (1:1) metal‐to‐ligand ratio. Electronic spectra magnetic moments can be applied derive data concerning geometric formations. activation thermodynamic variables related thermal breakdown identified using Coats–Redfern approach. coordinates Cu(II) through square planner geometry, Fe(III) into octahedral VO(II) pyramidal based on correlation techniques used inquiry DFT calculation. novel tested DNA binding spectroscopy, viscosity, gel electrophoresis. Intercalation or replacement modes hypothesized their interaction CT‐DNA. Molecular docking studies conducted analyze protein‐generated compounds' affinity. antibacterial, anticancer, antioxidant properties evaluated vitro. ESSAPd excelled over free ineffective therapy.

Язык: Английский

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Facile synthesis, structural elucidation, non-linear optical properties and biological evaluation of some novel tetra-dentate azomethine complexes supported by DFT calculation and molecular docking approach

Journal of Molecular Structure, Год журнала: 2024, Номер 1326, С. 141083 - 141083

Опубликована: Дек. 13, 2024

Язык: Английский

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Phytochemical‐Mediated Copper Oxide Nanoparticles Using Cheilocostus speciosus and Gardenia gummifera: Design, Synthesis, and Antimicrobial Evaluation Through In Silico and In Vitro Approaches

ChemistrySelect, Год журнала: 2025, Номер 10(7)

Опубликована: Фев. 1, 2025

Abstract In this study, we synthesized copper oxide nanoparticles using leaf extracts of two Indian medicinal plants, Cheilocostus speciosus (CS) and Gardenia gummifera (GG) , for the first time. The environmentally sustainable synthesis CuO NPs from Cu(NO 3 ) 2 uses phytochemical capping stabilizing properties. UV‐DRS, X‐ray diffraction (XRD), Fourier transform‐infrared (FT‐IR), XPS, SEM‐EDS, TEM‐SAED confirmed CS‐CuO GG‐CuO NP structure morphology. UV‐DRS diffuse reflectance spectra show absorption bands at 218–350 406–554 nm. Functional group studies were done FT‐IR. XRD patterns monoclinic phases average sizes 4.62 11.85 Morphological used SEM‐EDX TEM‐SAED. Biosynthesized CuO‐NPs tested against Gram‐negative, Gram‐positive, Aspergillus niger Candida albicans . CS‐ inhibited Escherichia coli Staphylococcus aureus with 18‐ 16‐mm zones, respectively. Bioinspired kill many bacterial strains, making them useful in nanobiotechnology. Molecular modelling determined S. nucleoside diphosphate kinase receptor's bonding affinity inhibition probability phytochemicals present extract. silico pharmacokinetics prediction physiochemical parameters predicted drug‐likeness non‐toxic behavior phytochemicals. Overall, current research demonstrates an utilizing CS GG, providing a alternative to traditional methods. antimicrobial efficacy these fungal strains addresses growing demand novel strategies counter microbial resistance. addition, molecular further emphasis safety phytochemicals, underscoring their significance nanobiotechnology drug development. This multidisciplinary approach illustrates extensive relevance our efforts promoting green chemistry strategies.

Язык: Английский

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Fabrication of a novel ZnO/Lu2O3 nanomaterial for the photocatalytic disposal of methylene blue dye under solar cell illumination

Journal of Materials Science Materials in Electronics, Год журнала: 2025, Номер 36(5)

Опубликована: Фев. 1, 2025

Язык: Английский

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Chitosan/betanin-silver nanocomposite: Synthesis, characterization and anticancer activity

Inorganic Chemistry Communications, Год журнала: 2025, Номер unknown, С. 114234 - 114234

Опубликована: Март 1, 2025

Язык: Английский

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Synthesis and characterization of Zn doped CoFe2O4 magnetic nanoparticles and their antimicrobial and wound healing assay

Results in Physics, Год журнала: 2025, Номер unknown, С. 108210 - 108210

Опубликована: Март 1, 2025

Язык: Английский

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One-step electrochemical synthesis of CuxO–ZnO for antifungal activity

Applied Nanoscience, Год журнала: 2025, Номер 15(3)

Опубликована: Апрель 19, 2025

Язык: Английский

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Efficient RhB degradation and antimicrobial activity with molecular docking study of polymers doped ZnSe nanostructure

Inorganic Chemistry Communications, Год журнала: 2024, Номер unknown, С. 113478 - 113478

Опубликована: Ноя. 1, 2024

Язык: Английский

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Ultrasound-assisted biosynthesis of gelatin-silver nanocomposite for the treatment of breast cancer by investigating the P53 and STAT3 signaling pathways

Journal of Molecular Structure, Год журнала: 2024, Номер unknown, С. 141240 - 141240

Опубликована: Дек. 1, 2024

Язык: Английский

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