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A comprehensive analysis of the molecular packing in the crystal of (4-methoxyphenyl) methyl 4-(4-chlorophenyl)-1, 3-thiazole-2-carboxylate: insights of X-ray …
The novel thiazole derivative (4-methoxyphenyl) methyl 4-(4-chlorophenyl)-1, 3-thiazole-2-
carboxylate (w26) was synthesized by the condensation reaction (CR) and spectroscopically …
carboxylate (w26) was synthesized by the condensation reaction (CR) and spectroscopically …
Structural elucidation, Hirshfeld surface, DFT, molecular docking and molecular dynamics studies of a novel thiazole derivative as anti-cancer drug
Detailed structural and non-covalent interactions in the novel thiazole derivative benzyl 4-(4-
chlorophenyl) thiazole-2-carboxylate (6a) has been synthesized and characterized by …
chlorophenyl) thiazole-2-carboxylate (6a) has been synthesized and characterized by …
In silico studies of thiazole derivative towards its potential use against SARS-CoV-2: An intuition from an experimental and computational approach
Abstract The N-(4-methoxyphenyl)-4-phenylthiazole-2-carboxamide (TT7) obtained via
cyclization of methyl 2-((4-methoxyphenyl) amino)-2-oxoethanedithioate with ɑ-haloketone …
cyclization of methyl 2-((4-methoxyphenyl) amino)-2-oxoethanedithioate with ɑ-haloketone …
A new Thiadiazole-triazine derivative: Structural investigation, DFT studies, ADME-T analysis and SARS-CoV-2 activity by docking simulation
S Kumar, K Divya, M Sridhar, M Mahendra - Journal of Molecular …, 2024 - Elsevier
The present work involves the synthesis of thiadiazole-triazine derivative 7-[2-(4-
bromophenyl) ethenyl]-3‑tert‑butyl‑4H-[1, 3, 4] thiadiazolo [2, 3-c][1, 2, 4] triazin-4-one …
bromophenyl) ethenyl]-3‑tert‑butyl‑4H-[1, 3, 4] thiadiazolo [2, 3-c][1, 2, 4] triazin-4-one …
Structure elucidation and computational studies of the thiazole derivative against SARS-CoV-2 virus: Insights from XRD, DFT, molecular docking, and molecular …
The present work is focused on the crystal structure, Hirshfeld surface, Density Functional
Theory (DFT) studies of thiazole derivative N-benzyl-4-(4-bromophenyl) thaiazole-2 …
Theory (DFT) studies of thiazole derivative N-benzyl-4-(4-bromophenyl) thaiazole-2 …
The study of the role of non-covalent interactions (CH⋯ N, CH⋯ π, CO⋯ CO, and π⋯ π) towards crystal packing of benzyl 4-(4-flurophenyl) thiazole-2-carboxylate: A …
This research article provides a extensive investigation into the synthesis, structural
analysis, and other physicochemical properties of a novel thiazole derivative benzyl 4-(4 …
analysis, and other physicochemical properties of a novel thiazole derivative benzyl 4-(4 …