Green and Four-Component Cyclocondensation Synthesis and in Silico Docking of New Polyfunctionalized Pyrrole Derivatives As the Potential Anticholinesterase Agents

Green and Four-Component Cyclocondensation Synthesis and in Silico Docking of New Polyfunctionalized Pyrrole Derivatives As the Potential Anticholinesterase Agents Publisher Pubmed

Meshkatalsadat MH¹ ; Mahmoudi A² ; Lotfi S³ ; Pouramiri B¹ ; Foroumadi A⁴

Show Affiliations

1. Department of Chemistry, Faculty of Science, Qom University of Technology, Qom, 37195, Iran
2. Department of Chemistry, Shahid Bahonar University of Kerman, Kerman, Iran
3. Department of Biotechnology, Institute of Science and High Technology and Environmental Sciences, Graduate University of Advanced Technology, Kerman, Iran
4. Department of Medicinal Chemistry, Faculty of Pharmacy, Tehran University of Medical Sciences, Tehran, Iran

Source: Molecular Diversity Published:2022

Abstract

Synthesis of new substituted pyrrole scaffolds containing substituted thiadiazol-2-amine moiety was successfully developed through one-pot and multi-component tandem condensation reaction utilizing of triethyl ammonium hydrogen sulfate ([Et3NH][HSO4]) ionic liquid as a green media under solvent-free conditions. The chemical structures of all newly synthesized compounds were fully characterized by spectroscopic methods (IR, 1H NMR, 13C NMR) and elemental analyzes. The molecular docking studies were also performed to predict the possible binding sites of the derivatives on the active site gorge of cholinesterase enzymes (AChE and BuChE). The results showed that all the seventeen derivatives interact with the enzymes with high affinity and among them 7d and 7f possess the greatest ability to bind to AChE and BuChE, respectively. © 2022, The Author(s), under exclusive licence to Springer Nature Switzerland AG.

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Alireza Foroumadi (3)

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Style	Citing Format
MLA	Meshkatalsadat MH, et al.. "Green and Four-Component Cyclocondensation Synthesis and in Silico Docking of New Polyfunctionalized Pyrrole Derivatives As the Potential Anticholinesterase Agents." Molecular Diversity, vol. 26, no. 6, 2022, pp. 3021-3035.
APA	Meshkatalsadat MH, Mahmoudi A, Lotfi S, Pouramiri B, Foroumadi A (2022). Green and Four-Component Cyclocondensation Synthesis and in Silico Docking of New Polyfunctionalized Pyrrole Derivatives As the Potential Anticholinesterase Agents. Molecular Diversity, 26(6), 3021-3035.
Chicago	Meshkatalsadat MH, Mahmoudi A, Lotfi S, Pouramiri B, Foroumadi A. "Green and Four-Component Cyclocondensation Synthesis and in Silico Docking of New Polyfunctionalized Pyrrole Derivatives As the Potential Anticholinesterase Agents." Molecular Diversity 26, no. 6 (2022): 3021-3035.
Harvard	Meshkatalsadat MH et al. (2022) 'Green and Four-Component Cyclocondensation Synthesis and in Silico Docking of New Polyfunctionalized Pyrrole Derivatives As the Potential Anticholinesterase Agents', Molecular Diversity, 26(6), pp. 3021-3035.
Vancouver	Meshkatalsadat MH, Mahmoudi A, Lotfi S, Pouramiri B, Foroumadi A. Green and Four-Component Cyclocondensation Synthesis and in Silico Docking of New Polyfunctionalized Pyrrole Derivatives As the Potential Anticholinesterase Agents. Molecular Diversity. 2022;26(6):3021-3035.
BibTex	@article{ author = {Meshkatalsadat MH and Mahmoudi A and Lotfi S and Pouramiri B and Foroumadi A}, title = {Green and Four-Component Cyclocondensation Synthesis and in Silico Docking of New Polyfunctionalized Pyrrole Derivatives As the Potential Anticholinesterase Agents}, journal = {Molecular Diversity}, volume = {26}, number = {6}, pages = {3021-3035}, year = {2022} }
RIS	TY - JOUR AU - Meshkatalsadat MH AU - Mahmoudi A AU - Lotfi S AU - Pouramiri B AU - Foroumadi A TI - Green and Four-Component Cyclocondensation Synthesis and in Silico Docking of New Polyfunctionalized Pyrrole Derivatives As the Potential Anticholinesterase Agents JO - Molecular Diversity VL - 26 IS - 6 SP - 3021 EP - 3035 PY - 2022 ER -

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