Electrochemical selenylative ipso-Annulation of N-benzylacrylamides to seleno-azaspiro[4.5]decadienones

Organic & Biomolecular Chemistry, Год журнала: 2024, Номер 22(30), С. 6141 - 6148

Опубликована: Янв. 1, 2024

Construction of seleno azaspiro[4.5]decadienones using an electrochemical approach is achieved via domino selenylation/ ipso -annulation.

Язык: Английский

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Discovery of Novel and Selective Schiff Base Inhibitors as a Key for Drug Synthesis, Molecular Docking, and Pharmacological Evaluation

ACS Omega, Год журнала: 2024, Номер 9(28), С. 31148 - 31158

Опубликована: Июль 3, 2024

Diabetes mellitus (DM) is a chronic disorder and still challenge throughout the world, therefore search for safe effective inhibitors α-amylase α-glucosidase increasing day by day. In this work, we try to carry out synthesis, modification, computer-aided results of biological research on thiadiazole-based Schiff base derivatives evaluate their in vitro inhibitory potential (1–15). current series, all synthesized analogues were shown have effects targeted enzymes. The IC50 values ranged from 20.10 ± 0.40 0.80 0.05 μM, compared with standard drug acarbose having an value 10.30 0.20 while α-glucosidase, 0.50 1.20 0.10 9.80 μM. For better understanding, SAR investigation was undertaken. nine scaffolds (1, 2, 3, 6, 9, 10, 11, 13, 15) more active than reference docking parameter RMSD 1.766, 2.7746, 1.6025, 2.2112, 3.5860, 2.3360, 1.6178, 2.0254, 2.0797 2.6020, 1.9509, 3.1642, 1.7547, 2.2130, 1.4221, 1.1087, respectively. toxicity selected calculated using OSIRIS tool, TPSA found be lower 140 represent drug-like properties; those Molinspiration studied as well. following properties properties. remaining (4, 5, 7, 8, 12, 14) also identified both enzymes, but they less due substituents attached aromatic parts. structures compounds confirmed through different spectroscopic analyses.

Язык: Английский

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A DFT Calculations of Mechanical, Optoelectronic and Transport Properties of Cubic AMgI3 (A = Li/Na) Halides for Photovoltaic and Energy Conversion Applications

Journal of Inorganic and Organometallic Polymers and Materials, Год журнала: 2024, Номер unknown

Опубликована: Авг. 14, 2024

Язык: Английский

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Examination the potential of Co doped nanocages (Co-C72, Co-Si72 and Co-Al36N36) as catalysts for N2 reduction to NH3 by theoretical methods

Inorganic Chemistry Communications, Год журнала: 2024, Номер 162, С. 112080 - 112080

Опубликована: Янв. 21, 2024

Язык: Английский

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Synthesis of magnetic nanoparticle (Pd-DBA@NiFe2O4) as a novel, green, efficient, and heterogeneous catalyst for C–S and C-C cross-coupling reactions

Journal of Molecular Structure, Год журнала: 2024, Номер 1312, С. 138539 - 138539

Опубликована: Май 5, 2024

Язык: Английский

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