Synthesis, Characterization, in silico DFT, Molecular docking, ADMET Profiling Studies and Toxicity Predictions of Ag(I) Complex Derived from 4‐Aminoacetophenone

ChemistrySelect, Год журнала: 2024, Номер 9(4)

Опубликована: Янв. 22, 2024

Abstract The reaction of the synthesized (E)‐1‐(4‐((2,4‐dihydroxy‐6‐methylphenyl)diazenyl)phenyl)ethan‐1‐one, (DMPDE) ligand with Ag(I) ion at room temperature resulted in formation complex; [Ag(DMPDE)(H 2 O) ]. 1 H NMR, 13 C FTIR, UV‐Vis, mass spectra, elemental analyses, thermal analysis (TGA/DTA), and molar conductance measurements were done to elucidate structure synthetic compounds. results revealed an interesting geometrical variation; tetrahedral for complex. FT‐IR spectra demonstrated that under investigation behaves as a bidentate (N,O) through nitrogen atom azo group which is farthest acetophenone moiety oxygen phenolic benzene forms stable five‐membered chelating ring. electronic structure, molecular electrostatic potential (MEP) quantum chemical calculations newly compounds are investigated theoretically DFT/B3LYP level theory. Additionally, complex screened against growth pathogenic bacteria [ Actinomycosis (G + ), E. Escherichia Coli − )] fungi ( Penicillium spp .) compared reference antibiotics, Chloramphenicol Nystatin. Furthermore, 1,1‐diphenyl‐2‐picrylhydrazyl (DPPH) was used evaluate antioxidant activities its complex, showed they both possess significant properties comparison L‐ascorbic acid (Vit. C) standard. Based on docking studies, greater affinity (PDB ID: 3T88), corresponds coli protein (−6.7818 kcal/mol) (−6.7928 kcal/mol), respectively. Interestingly, most active inside site cervical cancer receptor 4XR8) higher binding energy (−6.2631 than free (−5.8561 kcal/mol). In silico, ADMET displayed obey Lipinski rule “Veber's rule. Consequently, likely exhibit oral bioavailability good LD 50 safety profile includes non‐cytotoxicity, non‐immunotoxicity, non‐skin sensitization. Finally, anticancer activity human cell lines HeLa SiHa positive controls (cisplatin) normal hepatic cells (WRL‐68). present study, all tested promising whose IC value ranged from (61.02 71.09) μg/mL.

Язык: Английский

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Recent Advances in Schiff Base Coinage Metal Complexes as Anticancer Agents: A Comprehensive Review (2021–2025)

Dyes and Pigments, Год журнала: 2025, Номер unknown, С. 112710 - 112710

Опубликована: Фев. 1, 2025

Язык: Английский

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Transition Metal Complexes of Thiosemicarbazides, Thiocarbohydrazides, and Their Corresponding Carbazones with Cu(I), Cu(II), Co(II), Ni(II), Pd(II), and Ag(I)—A Review

Molecules, Год журнала: 2023, Номер 28(4), С. 1808 - 1808

Опубликована: Фев. 14, 2023

This review focuses on some interesting and recent applications of transition metals towards the complexation thiosemicarbazides, thiocarbohydrazides, their corresponding carbazones. We started with a description chosen five metals, including Cu[Cu(I), Cu(II], Co(II), Ni(II), Pd(II), Ag(I) electronic configurations. The stability assigned complexes was also discussed. shed light different routes describing synthesis these ligands. reported examples Cu(I), Cu(II), Ag(I), Pd(II) thiosemicarbazide thiocarbohydrazide (until 2022). deals summary fruitful use metal thiosemicarbazones thiocarbazones ligands in field catalysis. Finally, this related to biological importance.

Язык: Английский

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Recent progress in dichalcophosphate coinage metal clusters and superatoms

Chemical Communications, Год журнала: 2023, Номер 59(47), С. 7182 - 7195

Опубликована: Янв. 1, 2023

Atomically precise clusters of group 11 metals (Cu, Ag, and Au) attract considerable attention owing to their remarkable structure fascinating properties. One the unique subclasses these is based on dichalcophosphate ligands [(RO)2PE2]- type (E = S or Se, R alkyl). These successfully stabilise most diverse Cu, Au superatoms, spanning from simple ones amazing assemblies featuring unusual structural bonding patterns. It noteworthy that such complicated are assembled directly cheap reagents, metal(I) salts anions. This reaction, when performed in presence a hydride other anion sources, foreign metal ions, results hydrido- anion-templated homo- heteronuclear structures. In this feature article, we survey recent advances exciting field, highlighting powerful synthetic capabilities system "a salt - [(RO)2PX2]- templating borohydride" as an inexhaustible platform for creation new atomically clusters, nanoalloys.

Язык: Английский

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Sythesis, characterisation, anticancer and antimicrobial activity of Ag-N-heterocyclic carbene complexes containing benzimidazole derivatives

Inorganica Chimica Acta, Год журнала: 2024, Номер 565, С. 121992 - 121992

Опубликована: Фев. 22, 2024

Язык: Английский

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Noble Metal Complexes in Cancer Therapy: Unlocking Redox Potential for Next-Gen Treatments

Inorganics, Год журнала: 2025, Номер 13(2), С. 64 - 64

Опубликована: Фев. 19, 2025

(1) Context: Cancer is still a major problem worldwide, and traditional therapies like radiation chemotherapy often fail to alleviate symptoms because of side effects, systemic toxicity, mechanisms resistance. Beneficial anticancer effects that spare healthy tissues are made possible by the distinctive redox characteristics noble metal complexes, especially those containing palladium, gold, silver, platinum. (2) Methods: The processes, molecular targets, therapeutic uses complexes in cancer have been subject much study over last 20 years; novel approaches ligand design, functionalization nanoparticles, tumor-specific drug delivery systems highlighted. (3) Results: Recent developments include Pt(IV) prodrugs terpyridine-modified Pt for enhanced selectivity decreased toxicity; platinum cisplatin, trigger reactive oxygen species (ROS) production DNA damage. Functionalized gold nanoparticles (AuNPs) improve targeted theranostic capabilities, while particularly Au(I) Au(III), inhibit redox-sensitive processes such as thioredoxin reductase (TrxR). (4) Conclusions: Ag(I)-based compounds (AgNPs) induce damage mitochondrial dysfunction taking advantage oxidative stress. As redox-based medicines, ability transform certain biochemical features treat more effectively selectively.

Язык: Английский

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Silver‐based Terpyridine Complexes as Antitumor Agents

Chemistry - A European Journal, Год журнала: 2023, Номер 29(37)

Опубликована: Март 16, 2023

Silver complexes bearing substituted terpyridine or tetra-2-pyridinylpyrazine ligands have been prepared and structurally characterised. The study of the anticancer properties silver with this type is scarce, despite possibilities combining metal ability for DNA binding. Here, antiproliferative activity, stability, CT-DNA binding, mechanism cell death these types derivatives are studied. High cytotoxicity against different tumour cells was observed, and, more important, a great selectivity index has detected between healthy lymphocytes T some compounds. interaction shown that able to interact by moderate intercalation. Furthermore, studies indicate promote apoptosis mitochondrial pathway.

Язык: Английский

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Experimental and computational studies of silver(I) dibenzoylmethane-based complexes, interaction with DNA/RNA/BSA biomolecules, and in vitro cytotoxic activity

Journal of Inorganic Biochemistry, Год журнала: 2023, Номер 241, С. 112132 - 112132

Опубликована: Янв. 20, 2023

Язык: Английский

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Silver and Copper Complexes with Ibuprofen and Caffeine—Preparation and Evaluation of Their Selected Biological Effects

Molecules, Год журнала: 2024, Номер 29(2), С. 506 - 506

Опубликована: Янв. 19, 2024

Several organometallic complexes based on more than twenty different metals have already been approved for medical applications. The aim of the presented research was to obtain silver and copper with non-steroidal anti-inflammatory drugs ibuprofen xanthine alkaloid caffeine evaluate selected aspects their bioactivity biosafety in terms future possible obtained were characterized by Fourier-transform infrared spectroscopy, thermogravimetry, UV-VIS conductometry, elemental analysis, bioassays. Cytotoxicity normal human cells CCD-Co18 cell line evaluated determining IC50 value, metabolic morphology assessments. It observed that containing exhibited lower toxicity those only. Complexes showed towards healthy fibroblasts compared silver-based compounds, an above 140 μg mL−1. However, complexes, presence increased potency COX-2 inhibition. Antimicrobial effects against Gram-positive Gram-negative bacterial strains MIC determination values less 20

Язык: Английский

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Effect of fluorination on the cytotoxic potentials of benzimidazolium-based N-heterocyclic carbene ligands and their silver(I) complexes

Inorganica Chimica Acta, Год журнала: 2024, Номер 567, С. 122040 - 122040

Опубликована: Март 27, 2024

Язык: Английский

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