Two- and three-directional synthesis by 3–7CRs of novel (imidazolidine/thiazolidine)-2,4-diones: preparation, antibacterial, anticonvulsant, and molecular docking investigation

Nyaki, Hadiseh Yazdani; Mahmoodi, Nosrat O.; Nahzomi, Hossein Taherpour; Kokhdan, Esmaeel Panahi

doi:10.1007/s11164-023-05058-8

Cited by 9 publications

(2 citation statements)

References 59 publications

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“…Docking calculations on human topoisomerase II alpha (5GWK) and Acetylcholinesterase (7AIX) were performed using the Schrodinger program package. [41,[60][61][62] The predicted structures of some compounds are shown in Figure 5. The 2D ligandreceptor interaction diagrams of the structures located with the targets and the 3D binding models of the compounds that have a high score for the mentioned receptors are displayed in Figures 6 and 7.…”

Section: Computational Studymentioning

confidence: 99%

Synthesis, Characterization, Molecular Docking, and Investigation of Antibacterial Properties of New Derivatives of 1‐H‐Phenanthro [9,10‐d] Imidazole

Mahmoodi,

Rajabi,

Nyaki

et al. 2024

Chemistry & Biodiversity

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In this study, several imidazole derivatives in one pot multicomponent reaction from various aldehydes (1(a‐z)), 9,10‐phenanthrenequinone, or benzyl (2), and ammonium acetate (3) were synthesized in the presence of acetic acid (AcOH) under reflux conditions at 120°C. Also, the photochromic properties of synthesized compounds were investigated in AcOH as a solvent under laboratory conditions at a temperature of 120°C. Moreover, the antibacterial and antioxidant activity of the synthesized compounds was investigated. The structure of the products was confirmed using FT‐IR, UV‐Vis, 1HNMR, and 13CNMR spectroscopy. The antimicrobial activity of these compounds against gram‐positive bacteria including Bacillus subtilis (B.s) and gram‐negative bacteria including Escherichia coli (E. coli) bacteria was evaluated by the well diffusion (WD) method, and the compounds 4o showed significant results for both antibacterial activity. To gain insight into how these compounds interact with two types of targets, i.e., human topoisomerase II alpha (5GWK) and acetylcholinesterase (7AIX), binding calculations have been used that provide significant results for both targets and show that most ligands can effectively bind to cleft nucleotides. Interfere in the first one or be well placed in them. Hydrophobic pocket in the dimension, which can ultimately lead to high scores achieved.

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Section: Computational Studymentioning

confidence: 99%

Synthesis, Characterization, Molecular Docking, and Investigation of Antibacterial Properties of New Derivatives of 1‐H‐Phenanthro [9,10‐d] Imidazole

Mahmoodi,

Rajabi,

Nyaki

et al. 2024

Chemistry & Biodiversity

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“…Through the optimization, multicomponent reactions Knoevenagel condensation (method A) and Bucherer–Bergs (method B), a novel series of compounds ( 84 ) with two or three biologically active nuclei of imidazolidine-2,4-dione and thiazolidine-2,4-dione (TZD) were prepared and characterize via FT-IR, 1 HNMR, 13 CNMR, and elemental analysis. 104 All the compounds were put through molecular docking experiments for anticonvulsant drug binding (ADB) to the VGCIP i.e. , voltage-gated sodium channel inner pore to assess the anticonvulsant activity of these conjugates.…”

Section: Biological Activities Of S-triazine-based Heterocyclic Hybridsmentioning

confidence: 99%

Recent biological applications of heterocyclic hybrids containings-triazine scaffold

Ali,

Naseer

2023

RSC Adv.

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Synthesis, biological evaluation and molecular dynamics simulations of new sulfonylurea derivatives bearing biphenyl moieties as potential NLRP3 inhibitors

Xiong,

Zhang,

Min

et al. 2024

Res Chem Intermed

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Two- and three-directional synthesis by 3–7CRs of novel (imidazolidine/thiazolidine)-2,4-diones: preparation, antibacterial, anticonvulsant, and molecular docking investigation

Cited by 9 publications

References 59 publications

Synthesis, Characterization, Molecular Docking, and Investigation of Antibacterial Properties of New Derivatives of 1‐H‐Phenanthro [9,10‐d] Imidazole

Synthesis, Characterization, Molecular Docking, and Investigation of Antibacterial Properties of New Derivatives of 1‐H‐Phenanthro [9,10‐d] Imidazole

Recent biological applications of heterocyclic hybrids containings-triazine scaffold

Synthesis, biological evaluation and molecular dynamics simulations of new sulfonylurea derivatives bearing biphenyl moieties as potential NLRP3 inhibitors

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