Recent investigations into synthesis and pharmacological activities of phenoxy acetamide and its derivatives (chalcone, indole and quinoline) as possible therapeutic …
FH Al-Ostoot, Zabiulla, S Salah, SA Khanum - Journal of the Iranian …, 2021 - Springer
Medicinal chemistry can rightfully be regarded as a cornerstone in the public health of our
modern society that combines chemistry and pharmacology with the aim of designing and …
modern society that combines chemistry and pharmacology with the aim of designing and …
Synthesis of biologically active sulfonamide-based indole analogs: a review
I Mushtaq, A Ahmed - Future Journal of Pharmaceutical Sciences, 2023 - Springer
The class of heterocyclic compounds exhibits a variety of pharmacological actions, long
employed as an active ingredient in drug design and production. Indole and its derivatives …
employed as an active ingredient in drug design and production. Indole and its derivatives …
Coumarin-benzothiazole based azo dyes: synthesis, characterization, computational, photophysical and biological studies
B Manjunatha, YD Bodke, O Nagaraja… - Journal of Molecular …, 2021 - Elsevier
In this paper, we have reported the synthesis of some coumarin-benzothiazole based azo
dyes (C 1-C 5). The structure of the synthesised dyes was precisely established from their …
dyes (C 1-C 5). The structure of the synthesised dyes was precisely established from their …
Competent synthesis of biaryl analogs via asymmetric Suzuki–Miyaura cross-coupling for the development of anti-inflammatory and analgesic agents
HD Gurupadaswamy, VL Ranganatha, R Ramu… - Journal of the Iranian …, 2022 - Springer
Based on the core structure of diflunisal drug, herein, we report a resembling series of biaryl
analogs (3a–j) containing halogens, nitro, and methoxy substituents. They were designed …
analogs (3a–j) containing halogens, nitro, and methoxy substituents. They were designed …
Synthesis, crystal structure, DFT calculations, Hirshfeld surface analysis, energy frameworks, molecular dynamics and docking studies of novel isoxazolequinoxaline …
N Abad, HH Sallam, FH Al-Ostoot, HA Khamees… - Journal of Molecular …, 2021 - Elsevier
Quinoxaline derivatives with the molecular formula [C 8 H 6 N 2] also named
benzopyrazines, which are a valuable class of heterocyclic compounds useful for their …
benzopyrazines, which are a valuable class of heterocyclic compounds useful for their …
Computer-aided discovery of bis-indole derivatives as multi-target drugs against cancer and bacterial infections: DFT, docking, virtual screening, and molecular …
Recently, more complex diseases of seemingly incurable pathology have demonstrated the
need for potent and multi-target drugs. Specific to many cancers and bacterial diseases …
need for potent and multi-target drugs. Specific to many cancers and bacterial diseases …
New bis hydrazone: synthesis, X-ray crystal structure, DFT computations, conformational study and in silico study of the inhibition activity of SARS-CoV-2
A Tabbiche, A Bouchama, N Chafai, F Zaidi… - Journal of Molecular …, 2022 - Elsevier
The aim of this work was to synthesize new bis hydrazone derived from benzil in good yield,
namely:(1Z, 2Z)-1, 2-bis (3-Chlorophenyl Hydrazino) Benzil, encoded by 3-Cl BHB. The …
namely:(1Z, 2Z)-1, 2-bis (3-Chlorophenyl Hydrazino) Benzil, encoded by 3-Cl BHB. The …
Structural and theoretical exploration of a multi-methoxy chalcone: Synthesis, quantum theory, electrostatics, molecular packing, DFT analysis, and in-silico anti …
FH Al-Ostoot, P Akhileshwari, VH Kameshwar… - Heliyon, 2024 - cell.com
This study explores the pharmacological potential of chalcones through a multidisciplinary
approach, including synthesis, quantum theory, molecular electrostatics, and density …
approach, including synthesis, quantum theory, molecular electrostatics, and density …
Bifunctionalization of α, β-unsaturated diaryl ketones into α-aryl-β, β-ditosyloxy ketones: Single crystal XRD, DFT, FMOs, molecular electrostatic potential, hirshfeld …
Environmentally benign synthesis, structural explication by means of IR, 1 H & 13 C NMR,
HRMS and crystal structure of two electronically different α-aryl-β, β-ditosyloxy ketones ie, 2 …
HRMS and crystal structure of two electronically different α-aryl-β, β-ditosyloxy ketones ie, 2 …
Synthesis, characterization, DFT, docking studies and molecular dynamics of some 3-phenyl-5-furan isoxazole derivatives as anti-inflammatory and anti-ulcer agents
HM Pallavi, FH Al-Ostoot, HK Vivek… - Journal of Molecular …, 2022 - Elsevier
A vast number of nitrogen heterocyclic derivatives comprising oxygen atom is considered as
a valuable combination of therapeutic agents in curative chemistry. In particular, isoxazole, a …
a valuable combination of therapeutic agents in curative chemistry. In particular, isoxazole, a …