Synthesis of bis(thiosemicarbazone) derivatives: Definition, crystal structure, biological potential and computational analysis

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dc.authorid0000-0001-7181-9556
dc.contributor.authorAteş, Davut
dc.contributor.authorGülcan, Mehmet
dc.contributor.authorGümüş, Selçuk
dc.contributor.authorŞekerci, Mehmet
dc.contributor.authorÖzdemir, Sadin
dc.contributor.authorŞahin, Ertan
dc.contributor.authorÇolak, Naki
dc.date.accessioned2019-05-13T08:58:52Z
dc.date.available2019-05-13T08:58:52Z
dc.date.issued2018
dc.departmentHitit Üniversitesi, Fen Edebiyat Fakültesi, Kimya Bölümü
dc.description.abstract(2-(2-(2-methoxyphenyl)hydrazono)cyclohexane-1,3-diylidene) bis(hydrazine carbothioamide) (L1), 4-(2-(-2,-6-bis(2-carbamothioylhydrazono) cyclohexylidene) hydrazinyl)benzoic acid (L2), and (2-(2-(4-bromophenyl) hydrazono) cyclohexane-1,3-diylidene) bis(hydrazinecarbothioamide) (L3) bis(thiosemicarbazone) derivative compounds were synthesized by the condensation reaction of thiosemicarbazide and various ketone compounds. The structures of synthesized compounds were characterized by using FT-IR, 1H and 13C-NMR spectra, elemental analysis and mass spectra. Also, the structure of L1 has been determined by X-ray crystallographic analysis. Additionally, the antioxidant activities (free radical (DPPH) scavenging, iron chelating and reducing power) of compounds were evaluated. Especially, L3 displayed good DPPH activity (84.13%) at 100 mg/L. Moreover, pBR322 plasmid DNA cleavage activity was examined and all of the compounds were able to cleave the plasmid DNA. Finally, the ground state geometries of the thiosemicarbazone derivatives were optimized using Density Functional Theory applications at B3LYP/6-31G (d,p) level in order to obtain information about the 3D geometries and electronic structure, © 2018 Taylor & Francis Group, LLC.
dc.identifier.citationAteş, D., Gülcan, M., Gümüş, S., Şekerci, M., Özdemir, S., Şahin, E., Çolak, N. (2018). Synthesis of bis (thiosemicarbazone) derivatives: Definition, crystal structure, biological potential and computational analysis. Phosphorus, Sulfur, and Silicon and the Related Elements, 193(1), 14-22.
dc.identifier.doi10.1080/10426507.2017.1370589
dc.identifier.endpage22en_US
dc.identifier.issn1042-6507
dc.identifier.issue1en_US
dc.identifier.scopusqualityQ3
dc.identifier.startpage14en_US
dc.identifier.urihttps://doi.org/10.1080/10426507.2017.1370589
dc.identifier.urihttps://hdl.handle.net/11491/1211
dc.identifier.volume193en_US
dc.identifier.wosqualityN/A
dc.indekslendigikaynakWeb of Science
dc.indekslendigikaynakScopus
dc.language.isoen
dc.publisherTaylor and Francis Ltd.
dc.relation.ispartofPhosphorus, Sulfur and Silicon and the Related Elements
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanı
dc.rightsinfo:eu-repo/semantics/closedAccess
dc.subjectAntioxidanten_US
dc.subjectComputational Analysisen_US
dc.subjectCrystal Structureen_US
dc.subjectDNA Cleavageen_US
dc.subjectThiosemicarbazoneen_US
dc.titleSynthesis of bis(thiosemicarbazone) derivatives: Definition, crystal structure, biological potential and computational analysis
dc.typeArticle

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