Synthesis, structure–activity relationship studies using density functional theory and in silico molecular docking on substituted benzohydrazide derivatives

PM Gurubasavaraj, VP Sajjan, BM Muñoz-Flores… - Journal of Molecular …, 2024 - Elsevier
The present study demonstrates the utility of benzohydrazide derivatives based on an
approach to identify potential targets for a series of synthesized compounds that show potent …

New2-((2-(2,4-dinitrophenyl)hydrazineeylidene) derivatives: design, synthesis, in silico, and in vitro anticancer studies

VP Sajjan, LB Anigol, PM Gurubasavaraj… - Journal of …, 2023 - Taylor & Francis
A series of novel hydrazone compounds have been synthesized by the condensation of
hydrazines and different substituted salicylaldehydes at a molar ratio of 1: 1 in one step …

Synthesis, investigation of the crystal structure, DFT calculations, and in silico medicinal potential of hydrazono-and aminomethylene substituted pyrazolidine-3, 5 …

Y El Bakri, SA Siddique, SK Mohamed… - New Journal of …, 2024 - pubs.rsc.org
Two new pyrazolidine-3, 5-dione derivatives namely (Z)-4-(2-(4-bromophenyl) hydrazono)-1-
phenylpyrazolidine-3, 5-dione (2) and (E)-1-phenyl-4-((pyridin-2-ylamino) methylene) …

Synthesis, In Vitro Anticancer Activity and In Silico Study of some Benzylidene Hydrazide Derivatives

MI Sulistyowaty, galih putra, T Budiati… - Key Engineering …, 2020 - Trans Tech Publ
Some benzylidenehydrazides (3a-e) have been synthesized in three reaction steps from
anthranilic acid in good yields, about 70%-99%. The structures of the synthesized …

Design, Synthesis, Biological Evaluation, and Molecular Docking Studies of 4‐Nitrobenzohydrazide Derivatives as Potential Anticancer Agents

VP Sajjan, PM Gurubasavaraj, D Patil… - …, 2023 - Wiley Online Library
A series of new acylhydrazone derivatives were synthesized from the condensation of
different substituted salicylaldehydes with 4‐nitrobenzohydrazide at a molar ratio of 1: 1 in a …

Design, synthesis, anti-proliferative, anti-microbial, anti-angiogenic activity and in silico analysis of novel hydrazone derivatives

H Ünver, B Berber, R Demirel… - Anti-Cancer Agents in …, 2019 - ingentaconnect.com
Background: Cancer is the second leading cause of death globally. Hydrazone and
hydrazone derivatives have high activity, and for this reason, these compound are greatly …

Synthesis, experimental and theoretical characterization of (E)-2-((2, 3-dimethylphenyl) amino)-N'-(furan-2-ylmethylene) benzohydrazide

MR Albayati, S Kansız, H Lgaz, S Kaya, N Dege… - Journal of Molecular …, 2020 - Elsevier
Hydrazone derivatives have drawn much attention because of their large pharmacological
applications. In the present work, the compound (E)-2-((2, 3-dimethylphenyl) amino)-N' …

Synthesis, characterization, anti-proliferative activity and chemistry computation of DFT theoretical methods of hydrazine-based Schiff bases derived from methyl …

S Parvarinezhad, M Salehi - Journal of Molecular Structure, 2021 - Elsevier
In this study, the synthesized hydrazine Schiff bases belonging to methyl acetoacetate (1)
and α-hydroxyacetophenone (2) were prepared by simple methods. In addition, FT-IR, UV …

[HTML][HTML] Synthesis, anticancer, molecular docking and QSAR studies of benzoylhydrazone

M Taha, S Sultan, M Herizal, MQ Fatmi… - Journal of Saudi …, 2019 - Elsevier
To find out effective anticancer compounds we synthesized (1–30) derivatives of 4-
isopropylbenzoylhydrazone and evaluated for anticancer potential. The compounds 3, 9, 12 …

Synthesis, Single Crystal X-Ray, Hirshfeld Surface Analysis and DFT Calculation Based NBO, HOMO–LUMO, MEP, ECT and Molecular Docking Analysis of N′-[(2,6 …

A Suhta, S Saral, U Çoruh, S Karakuş… - Journal of Structural …, 2024 - Springer
A new Schiff base compound of N′-[(2, 6-dichlorophenyl) methylidene]-2-{[3-(trifluoro-
methyl) phenyl] amino} benzohydrazide was synthesized and characterized through various …