Synthesis, Antimicrobial Evaluation, and Molecular Modeling Studies of New Thiosemicarbazide-Triazole Hybrid Derivatives of (<i>s</I>)-naproxen

dc.contributor.author Han, M. Ihsan
dc.contributor.author Ince, Ufuk
dc.contributor.author Gunduz, Miyase Gozde
dc.contributor.author Kucckguzel, S. Guniz
dc.contributor.other Eczacılık Meslek Bilimleri Bölümü
dc.date.accessioned 2025-01-11T13:00:34Z
dc.date.available 2025-01-11T13:00:34Z
dc.date.issued 2022
dc.description Gunduz, Miyase Gozde/0000-0002-2287-9509 en_US
dc.description.abstract The discovery of new antimicrobial molecules is crucial for combating drug-resistant bacterial and fungal infections that pose a dangerous threat to human health. In the current research, we applied a molecular hybridization approach to synthesize original thiosemicarbazide-triazole derivatives starting from (S)-naproxen (7a-7k). After structural characterization using FT-IR, H-1-NMR, C-13-NMR, and HR-MS, the obtained compounds were screened for their antimicrobial activities against Staphylococcus aureus ATCC 29213, Escherichia coli ATCC 25922, Candida albicans ATCC 10231 and their isolates, as well. Although all compounds were found to be moderate antimicrobial agents, in general, their antibacterial activities were better than antifungal effects. Among the tested compounds, 7j carrying nitrophenyl group on the thiosemicarbazide functionality represented the best MIC value against S. aureus isolate. Finally, molecular docking studies were performed in the active pocket of S. aureus flavohemoglobin to rationalize the obtained biological data. en_US
dc.description.sponsorship TUBITAK [215S009] en_US
dc.description.sponsorship MGG is grateful to Prof. Dr. Gerhard Wolber, Freie Universitat Berlin, for providing the license of LigandScout 4.2. The synthesis of compounds 1-6 was supported by a grant of TUBITAK (Project number: 215S009). (S)-Naproxen was supplied by Deva Pharmaceutical Industry Inc. en_US
dc.identifier.citation 8
dc.identifier.doi 10.1002/cbdv.202100900
dc.identifier.issn 1612-1872
dc.identifier.issn 1612-1880
dc.identifier.scopus 2-s2.0-85126198321
dc.identifier.uri https://doi.org/10.1002/cbdv.202100900
dc.identifier.uri https://hdl.handle.net/20.500.14627/37
dc.language.iso en en_US
dc.publisher Wiley-v C H verlag Gmbh en_US
dc.rights info:eu-repo/semantics/closedAccess en_US
dc.subject Antibacterial Activity en_US
dc.subject Antifungal Activity en_US
dc.subject Biological Activity en_US
dc.subject Drug Design en_US
dc.subject Thioether en_US
dc.title Synthesis, Antimicrobial Evaluation, and Molecular Modeling Studies of New Thiosemicarbazide-Triazole Hybrid Derivatives of (<i>s</I>)-naproxen en_US
dc.type Article en_US
dspace.entity.type Publication
gdc.author.id Gunduz, Miyase Gozde/0000-0002-2287-9509
gdc.author.institutional Küçükgüzel, Şükriye Güniz
gdc.author.scopusid 57196050609
gdc.author.scopusid 57219028491
gdc.author.scopusid 11440451800
gdc.author.scopusid 55894906300
gdc.author.wosid Küçükgüzel, Ş.Güniz/AAQ-8954-2021
gdc.author.wosid HAN, MUHAMMED İHSAN/ADF-1623-2022
gdc.author.wosid INCE, Ufuk/KFT-0343-2024
gdc.author.wosid Gunduz, Miyase Gozde/H-5541-2016
gdc.description.department Fenerbahçe University en_US
gdc.description.departmenttemp [Han, M. Ihsan] Erciyes Univ, Fac Pharm, Dept Pharmaceut Chem, TR-38039 Kayseri, Turkey; [Ince, Ufuk] Erciyes Univ, Fac Pharm, Dept Pharmaceut Microbiol, TR-38039 Kayseri, Turkey; [Gunduz, Miyase Gozde] Hacettepe Univ, Fac Pharm, Dept Pharmaceut Chem, TR-06100 Ankara, Turkey; [Kucckguzel, S. Guniz] Fenerbahce Univ, Fac Pharm, Dept Pharmaceut Chem, TR-34758 Istanbul, Turkey en_US
gdc.description.issue 4 en_US
gdc.description.publicationcategory Makale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanı en_US
gdc.description.scopusquality Q4
gdc.description.volume 19 en_US
gdc.description.woscitationindex Science Citation Index Expanded
gdc.description.wosquality Q3
gdc.identifier.pmid 35191589
gdc.identifier.wos WOS:000768882000001
gdc.scopus.citedcount 10
gdc.wos.citedcount 10
relation.isAuthorOfPublication ccdbdc32-5572-44d5-8ee3-7caed45f6422
relation.isAuthorOfPublication.latestForDiscovery ccdbdc32-5572-44d5-8ee3-7caed45f6422
relation.isOrgUnitOfPublication 5052e089-e75d-4aec-a280-6353973e4819
relation.isOrgUnitOfPublication.latestForDiscovery 5052e089-e75d-4aec-a280-6353973e4819

Files

Original bundle

Now showing 1 - 1 of 1
Loading...
Thumbnail Image
Name:
ChemistryBiodiversity-Naproxen.pdf
Size:
1.36 MB
Format:
Adobe Portable Document Format