Synthesis, Characterization, and In Vitro & In Silico Biological Evaluation of Novel Polyphenols Bearing Quinazolin-4(3H)-one Ring as Promising Anti Prostate Cancer Agents
Yazarlar (4)
Doç. Dr. Halil Şenol Bezm-İ Âlem Vakıf Üniversitesi, Türkiye
Dr. Öğr. Üyesi Zeynep Çağman Bezm-İ Âlem Vakıf Üniversitesi, Türkiye
Arş. Gör. Furkan Çakır Bezm-İ Âlem Vakıf Üniversitesi, Türkiye
Doç. Dr. Feyzi Sinan TOKALI Kafkas Üniversitesi, Türkiye
Makale Türü Özgün Makale (SSCI, AHCI, SCI, SCI-Exp dergilerinde yayınlanan tam makale)
Dergi Adı Synlett (Q2)
Dergi ISSN 0936-5214 Dergi Bilgileri (2025)
Dergi Tarandığı Indeksler SCI-Expanded
Makale Dili İngilizce Basım Tarihi 10-2025
Cilt / Sayı / Sayfa 36 / 16 / 2623–2630 DOI 10.1055/a-2500-7537
Makale Linki https://doi.org/10.1055/a-2500-7537
UAK Araştırma Alanları
Organik Kimya
Özet
AbstractIn this study, 12 novel polyphenols containing the quinazolin-4(3H)-one ring were synthesized and characterized using 1H/13C NMR and HRMS analyses, yielding the target compounds in excellent yields (88–96%). Biological evaluation revealed significant cytotoxic activity against PC3 prostate cancer and 3T3 fibroblast cell lines, with compounds 2,2′-(propane-1,3-diyl)bis-3-(2,4-dihydroxybenzylideneamino)quinazolin-4(3H)-one (5) and 2,2′-(propane-1,3-diyl)bis-3-(2,3,4-trihydroxybenzylideneamino)quinazolin-4(3H)-one (6) demonstrating the highest anticancer potential. Compound 6 exhibited the highest selectivity (IC50 = 5.72 µM, SI = 68), outperforming the reference drug, doxorubicin. In silico studies, including molecular docking and dynamics simulations, showed strong binding affinities for mTOR, P110α, and PARP1, particularly for compound 6. Key interactions, such as hydrogen bonds and π-π stacking, contributed to the stability of the 6–mTOR complex. These results highlight compounds 5 and 6 as promising candidates for prostate cancer therapy, with compound 6 showing superior selectivity and interaction profiles, providing the groundwork for further preclinical development.
Anahtar Kelimeler
cytotoxicity | hydrazone | molecular docking | molecular dynamics | prostate cancer | quinazolin-4(3H)-one
BM Sürdürülebilir Kalkınma Amaçları
Atıf Sayıları
Web of Science 6
Scopus 7
Google Scholar 8
Synthesis, Characterization, and In Vitro & In Silico Biological Evaluation of Novel Polyphenols Bearing Quinazolin-4(3H)-one Ring as Promising Anti Prostate Cancer Agents

Paylaş

İletişim
  • Kafkas Üniversitesi Rektörlüğü (36100) Merkez / KARS
  • unis@kafkas.edu.tr 4742251150 (474)225-1160
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