Synthesis and spectroscopic characterizations of hexakis[(1-(4 '-oxyphenyl)-3-(substituted-phenyl)prop-2-en-1-one)]cyclotriphosphazenes: their in vitro cytotoxic activity, theoretical analysis and molecular docking studies

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dc.authoridBahar, Mehmet Refik/0000-0002-7922-3850
dc.authoridUSLU, HARUN/0000-0001-8827-8557
dc.authoridAkman, Feride/0000-0001-5663-2021
dc.authoridTekin, Suat/0000-0002-2757-1802
dc.authoridGORGULU, AHMET/0000-0002-7549-1524
dc.authoridKORAN, KENAN/0000-0002-2218-7211
dc.authoridSandal, Suleyman/0000-0002-8916-3329
dc.authorwosidBahar, Mehmet Refik/ABI-6343-2020
dc.authorwosidUSLU, HARUN/P-3681-2019
dc.authorwosidAkman, Feride/JEF-0379-2023
dc.authorwosidGörgülü, Ahmet Orhan/AAQ-4282-2021
dc.authorwosidTekin, Suat/IZD-9868-2023
dc.authorwosidÇALIŞKAN, ERAY/W-6973-2018
dc.authorwosidTekin, Suat/AAG-1440-2021
dc.contributor.authorDogan, Hacer
dc.contributor.authorBahar, Mehmet Refik
dc.contributor.authorCaliskan, Eray
dc.contributor.authorTekin, Suat
dc.contributor.authorUslu, Harun
dc.contributor.authorAkman, Feride
dc.contributor.authorKoran, Kenan
dc.date.accessioned2024-08-04T20:49:05Z
dc.date.available2024-08-04T20:49:05Z
dc.date.issued2022
dc.departmentİnönü Üniversitesien_US
dc.description.abstractThe hexachlorocyclotriphosphaze compound (N3P3Cl6, HCCP) was reacted with excess (E)-(1-(4 '-oxyphenyl)-3-(substituted-phenyl)prop-2-en-1-ones (2-11) to produce hexakis[(1-(4-oxyphenyl)-3-(substituted-phenyl)prop-2-en-1-one)]cyclotriphosphazenes (CP 2-11). The structures of products (CP 2-11) were confirmed using elemental analysis, FT-IR, MS spectral analysis as well as P-31, H-1 and C-13-APT NMR techniques and their thermal properties determined by TGA and DSC techniques. The HOMO-LUMO energy gap and chemical reactivity identifiers were calculated and HOMO and LUMO images were viewed. According to the calculations, all the chemical potential values of CP 2-11 are negative and it shown that the molecules are stable. The in vitro cytotoxic of CP 2-11 investigated and their activity potentials were evaluated by molecular docking studies with Autodock Vina softwares. CP 2-11 compounds were found to demonstrate cytotoxic activity against human cancer cell lines (A2780, LNCaP and PC-3). The CP 2-11 compounds reduced the cell viability against all cancer cell lines in the range 36%-90% especially. The results showed that these compounds are powerful candidate molecules for pharmaceutical applications.en_US
dc.description.sponsorshipScientific and Technological Research Council of Turkey [116Z758]en_US
dc.description.sponsorshipThe Scientific and Technological Research Council of TurkeyThis work was supported by a grant from The Scientific and Technological Research Council of Turkey (Grant No: 116Z758).en_US
dc.identifier.doi10.1080/07391102.2020.1846621
dc.identifier.endpage3272en_US
dc.identifier.issn0739-1102
dc.identifier.issn1538-0254
dc.identifier.issue7en_US
dc.identifier.pmid33210560en_US
dc.identifier.scopus2-s2.0-85096315080en_US
dc.identifier.scopusqualityQ2en_US
dc.identifier.startpage3258en_US
dc.identifier.urihttps://doi.org/10.1080/07391102.2020.1846621
dc.identifier.urihttps://hdl.handle.net/11616/99633
dc.identifier.volume40en_US
dc.identifier.wosWOS:000590376800001en_US
dc.identifier.wosqualityN/Aen_US
dc.indekslendigikaynakWeb of Scienceen_US
dc.indekslendigikaynakScopusen_US
dc.indekslendigikaynakPubMeden_US
dc.language.isoenen_US
dc.publisherTaylor & Francis Incen_US
dc.relation.ispartofJournal of Biomolecular Structure & Dynamicsen_US
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanıen_US
dc.rightsinfo:eu-repo/semantics/closedAccessen_US
dc.subjectMTT assayen_US
dc.subjectspiro-phosphazeneen_US
dc.subjectcytotoxicityen_US
dc.subjectmolecular dockingen_US
dc.subjectstructural characterizationsen_US
dc.titleSynthesis and spectroscopic characterizations of hexakis[(1-(4 '-oxyphenyl)-3-(substituted-phenyl)prop-2-en-1-one)]cyclotriphosphazenes: their in vitro cytotoxic activity, theoretical analysis and molecular docking studiesen_US
dc.typeArticleen_US

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