DFT calculation, biological activity, anion sensing studies and crystal structure of (E)-4-chloro-2-[(pyridin-2-ylimino)-methyl]phenol

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dc.authoridBoyacioglu, Bahadir/0000-0003-3757-3622
dc.authoridUnver, Huseyin/0000-0003-3968-4385
dc.contributor.authorYildirim, Nuray
dc.contributor.authorDemir, Neslihan
dc.contributor.authorAlpaslan, Gokhan
dc.contributor.authorBoyacioglu, Bahadir
dc.contributor.authorYıldız, Mustafa
dc.contributor.authorUnver, Huseyin
dc.date.accessioned2025-01-27T20:56:13Z
dc.date.available2025-01-27T20:56:13Z
dc.date.issued2018
dc.departmentÇanakkale Onsekiz Mart Üniversitesi
dc.description.abstract(E)-4-Chloro-2-[(pyridin-2-ylimino)methyl]phenol was synthesized in the reaction of 2-aminopyridine with 5-chlorosalicylaldehyde. The structure of compound was investigated by FTIR, UV-Vis, 1H-NMR, C-13-NMR and X-ray data. In addition, characterization of the compound was realized using theoretical quantum mechanical calculations and experimental spectroscopic methods. The molecular structure of the compound was confirmed using X-ray single-crystal data, NMR, FTIR and UV-Vis, which were in good agreement with the structure predicted by the theoretical calculations using the density functional theory (DFT). Moreover, the antimicrobial activity of the compound was investigated against some bacteria and yeast cultures by the broth microdilution test. UV-Vis spectroscopy studies of the interactions between the Schiff base and calf thymus DNA (CT-DNA) showed that the compound interacts with CT-DNA via electrostatic binding. The colorimetric response of the compound receptors was investigated before and after the addition of an equivalent amount of each anion to evaluate anion recognition properties.
dc.description.sponsorshipScientific and Technical Research Council of Turkey (TUBITAK) [TUBITAK 115F253]
dc.description.sponsorshipThe authors are grateful to the Scientific and Technical Research Council of Turkey (TUBITAK) for the financial support of this work, Grant No. TUBITAK 115F253.
dc.identifier.doi10.2298/JSC171001009Y
dc.identifier.endpage721
dc.identifier.issn0352-5139
dc.identifier.issue6
dc.identifier.scopus2-s2.0-85049653338
dc.identifier.scopusqualityQ3
dc.identifier.startpage707
dc.identifier.urihttps://doi.org/10.2298/JSC171001009Y
dc.identifier.urihttps://hdl.handle.net/20.500.12428/26343
dc.identifier.volume83
dc.identifier.wosWOS:000437822100004
dc.identifier.wosqualityQ4
dc.indekslendigikaynakWeb of Science
dc.indekslendigikaynakScopus
dc.language.isoen
dc.publisherSerbian Chemical Soc
dc.relation.ispartofJournal of The Serbian Chemical Society
dc.relation.publicationcategoryinfo:eu-repo/semantics/openAccess
dc.rightsinfo:eu-repo/semantics/openAccess
dc.snmzKA_WoS_20250125
dc.subjectUV-Vis spectroscopy
dc.subject2-aminopyridine
dc.subjectanti-microbial activity
dc.subjectDNA binding
dc.subjectX-ray crystallography
dc.titleDFT calculation, biological activity, anion sensing studies and crystal structure of (E)-4-chloro-2-[(pyridin-2-ylimino)-methyl]phenol
dc.typeArticle

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