Molecular docking and biological assessment of substituted phthalazin‐1(2H)‐one derivatives

2, 4‐Disubstituted phthalazin‐1(2H)‐one derivatives were synthesized via nucleophilic attack of N‐2 of phthalazin‐1(2H)‐one derivatives on different alkyl halides. In addition, reactive phthalazinone acetohydrazide derivative was utilized as a scaffold to synthesize different heterocyclic systems. T...

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Veröffentlicht in:	Journal of heterocyclic chemistry 2020-04, Vol.57 (4), p.1845-1862
Hauptverfasser:	Mahmoud, Naglaa F. H., Elsayed, Galal A.
Format:	Artikel
Sprache:	eng
Schlagworte:	Anticancer properties Antiinfectives and antibacterials Biological activity Biological effects Derivatives Halides Molecular docking Synthesis
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container_end_page	1862
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container_title	Journal of heterocyclic chemistry
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creator	Mahmoud, Naglaa F. H. Elsayed, Galal A.
description	2, 4‐Disubstituted phthalazin‐1(2H)‐one derivatives were synthesized via nucleophilic attack of N‐2 of phthalazin‐1(2H)‐one derivatives on different alkyl halides. In addition, reactive phthalazinone acetohydrazide derivative was utilized as a scaffold to synthesize different heterocyclic systems. The assigned structures for all the newly synthesized derivatives were confirmed on the basis of elemental analyses and spectral data. Mechanistic illustrations for some of the synthesized compounds were also discussed. The synthesized compounds were evaluated for in vitro antimicrobial and antitumor activity. Most of the tested compounds exhibited significant potency as antimicrobial and antitumor agents. Moreover, MOE 2014.09 software was utilized to carry out computational studies to support the biological activity results.
doi_str_mv	10.1002/jhet.3913
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subjects	Anticancer properties Antiinfectives and antibacterials Biological activity Biological effects Derivatives Halides Molecular docking Synthesis
title	Molecular docking and biological assessment of substituted phthalazin‐1(2H)‐one derivatives
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