Biological activity of bis-(morpholineacetato) palladium (II) complex: Preparation, structural elucidation, cytotoxicity, DNA-/serum albumin-interaction, density functional …

M Feizi-Dehnayebi, E Dehghanian… - … Acta Part A: Molecular …, 2022 - Elsevier
In an effort to discover a novel potential bioactive compound, a mono-nuclear Pd (II)
complex with an amino acid derivative as ligand was synthesized and characterized through …

Synthesis, DFT, solvent effect and biological attributes of NLO active 4-bromo-2-((2-(2, 4-Dinitrophenyl) hydrazono) methyl) phenol-Potent drug anti-brain cancer

JNC Mishma, VB Jothy, B Narayana… - Journal of Molecular …, 2023 - Elsevier
The agrochemical and pharmaceutical sectors have relied heavily on heterocyclic aromatic
compounds. This work comprises the synthesis and investigation of a hydrazine derivative …

Effect of green solvents physical, chemical, biological and bonding nature on 5-acetyl-thiophene-2-carboxylic acid by DFT and TD-DFT approach–an antiviral agent

M Sumithra, N Sundaraganesan, KV Prasad… - Journal of the Indian …, 2023 - Elsevier
The density functional theory (DFT) is applied to 5-acetyl-thiophene-2-carboxylic acid
(5AT2CA). To determine the optimal structure and different physical, chemical, and …

Unravelling the thermodynamics and binding interactions of bovine serum albumin (BSA) with thiazole based carbohydrazide: Multi-spectroscopic, DFT and molecular …

P Rani, S Chahal, R Kataria, P Kumar, S Kumar… - Journal of Molecular …, 2022 - Elsevier
In the present manuscript, a novel 2-((4-chlorophenyl) amino)-N'-(4-(diethylamino)-2-
hydroxybenzylidene) thiazole-4-carbohydrazide (H1) has been synthesized and …

Synthesis, functional group analysis (experimental and theoretical), solvent–Solute interactions, structural insights of (E)-3-(4-chloro-3-(trifluoromethyl) phenyl) imino) …

VSJ Reeda, VB Jothy, M Asif, M Nasibullah… - Journal of Molecular …, 2023 - Elsevier
Abstract (E)-3-(4-chloro-3-(trifluoromethyl) phenyl) imino) indolin-2-one (4CTFI) has been
synthesised and its structural features have been investigated by spectroscopic (FT-IR, FT …

Synthesis, spectroscopic characterization (FT-IR, NMR) and DFT computational studies of new isoxazoline derived from acridone

M Aarjane, S Slassi, A Ghaleb, A Amine - Journal of Molecular Structure, 2021 - Elsevier
In this study, a new isoxazoline derived from acridone, 10‐{[3‐(4‐chlorophenyl)‐4, 5‐
dihydro‐1, 2‐oxazol‐5 yl] methyl} acridone (3) was successfully synthesized and …

Synthesis, Spectral, Crystal structure, Hirshfeld surface, Computational analysis, and Antimicrobial studies of Ethyl-(E)-4-(2-(2-arylidenehydrazinyl)-2-oxoethyl) …

M Rani, S Jayanthi, S Kabilan… - Journal of Molecular …, 2022 - Elsevier
A new series of ethyl-(E)-4-(2-(2-arylidenehydrazinyl)-2-oxoethyl) piperazine-1-carboxylates
(hydrazones) 4a-4e and 5a-5c were designed and synthesized from 1 …

5-Hydroxydibenzo [a, i] phenazine-8, 13-dione: A selective and sensitive colorimetric and fluorescent 'turn-off'sensor for iodide ion

P Rani, J Sindhu, S Kumar - Journal of Molecular Structure, 2023 - Elsevier
The present manuscript reports 5-hydroxydibenzo [a, i] phenazine-8, 13-dione (HDP) as a
novel colorimetric and fluorescent chemosensor for the selective and sensitive detection of …

Mixed ligand approach for novel hydrazide copper (II) complexes: Structural aspects, theoretical investigation and their biological evaluation

Richa, Kiran, N Kushwaha, E Jaiswal… - Applied …, 2023 - Wiley Online Library
In this paper, two novel Cu (II) complexes [CuL (S‐1‐amino‐2‐propanol)](R1) and [CuL (S‐2‐
amino‐1‐propanol)](R2) have been synthesized and characterized using Fourier transform …

Precisely designed oxazolonaphthoimidazo [1, 2-a] pyridine-based sensor for the detection of Fe3+ and DCP with cell imaging application

V Kathuria, P Rani, G Joshi, R Kumar, J Sindhu… - … of Photochemistry and …, 2023 - Elsevier
Two new turn-off fluorescent sensors (V3 and V4) presented in the article revealed the
potential application for the precise detection of Fe 3+ and diethylchlorophosphate (DCP) …