Synthesis, Diagnosis and Study of Molecular Docking for 4-(4-amino-5-mercapto-4H-1,2,4-triazol-3-yl) Phenol and Its Coordination with Some Metals
Keywords:
Acid Hydrazide ,Oxadazole, Triazol, , metal complex, Molecular Docking
Abstract
Triazol is an important nitrogen heterocyclic compound, containing three nitrogen atoms and two carbon atoms. Where triazole and its complexes were prepared by Acid Hydrazide (A1) was synthesis from the condensation of ester with hydrazine hydrate using ethanol absolute as a solvent. The next step involved the reaction of hydrazide acid, carbon sulfide (CS2), and ethanol to produce oxadazole (A2). Then, haydrazine hydrate was mixed with the triazole (A3) oxadiazole derivative. The complexes A4–A7 were produced by the reaction of the ligand (A3) with binary metal salts of the transition elements Co (II), Ni (II), Cu (II), and Mn (II). The reaction ratio of every complex that was produced was 1:1. The Ligand is Metal. The ligand was described using FT-IR, 1H, 13C-NMR, and elemental analysis (C.H.N.S.M.). The generated compounds were diagnosed using infrared spectroscopy (FT-IR) techniques, magnetic sensitivity at ambient temperature, and other approaches. The results showed that the atoms of sulfur and nitrogen coordinate ligand bidentate. The form of the octahedral complex is as follows
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References
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Strzelecka, M., and Swiatek, P. Triazoles as Important Antibacterial Agents. Pharmaceuticals (Basel) 114, 24. (2021).
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Sujana Oggu, Parameswari Akshinthala, LaxmiKumari Nagarapu, Srimannarayana Malempati. Design, synthesis, anticancer evaluation and molecular docking studies of 1,2,3-triazole incorporated 1,3,4-oxadiazole-Triazine derivatives. Heliyon, Volume 9, Issue 5, May 2023, e15935.
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Fallah, Z., Tajbakhsh, M., Alikhani, M., Larijani, B., FarAMARZI, M. A., Hamedifar, H., et al. A review on synthesis, mechanism of action, and structure-activity relationships of 1,2,3-triazole-based α-glucosidase inhibitors as promising anti-diabetic agents. J. Mol. Struct. 1255, 132469. (2022).
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Mashood Ahamed F.M., Shakya B., Shakya S. Synthesis and characterization of a novel Mannich base benzimidazole derivative to explore interaction with human serum albumin and antimicrobial property: experimental and theoretical approach. Journal of Biomolecular Structure and Dynamics, V. 41(18), p. 8701–8714 (2022).
Shihab A.S. Synthesis, Diagnosis, Evaluation of Biological Activity and Study of Molecular Docking for Furosemide Derivative and Its Coordination with Some Metals. Chemical Problems, V. 22 (3), p. 312-322. (2024).
Kogut M.M., Marcisz M., Samsonov S.A. Modeling glycosaminoglycan–protein complexes. Current Opinion in Structural Biology, V. 73, 102332, (2022).
Published
2024-10-15
How to Cite
Afraa Sabir Shihab. (2024). Synthesis, Diagnosis and Study of Molecular Docking for 4-(4-amino-5-mercapto-4H-1,2,4-triazol-3-yl) Phenol and Its Coordination with Some Metals. Central Asian Journal of Theoretical and Applied Science, 5(6), 543-554. Retrieved from https://cajotas.centralasianstudies.org/index.php/CAJOTAS/article/view/1509
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