New molecular hybrids of spirochromanone and carbamide: Design, synthesis, docking and in vitro anticancer studies

Result code in IS VaVaI
<a href="https://www.isvavai.cz/riv?ss=detail&h=RIV%2F61989592%3A15640%2F25%3A73636354" target="_blank" >RIV/61989592:15640/25:73636354 - isvavai.cz</a>
Alternative codes found
RIV/61989592:15110/25:73636354
Result on the web
<a href="https://www.sciencedirect.com/science/article/pii/S0019452225006120?via%3Dihub" target="_blank" >https://www.sciencedirect.com/science/article/pii/S0019452225006120?via%3Dihub</a>
DOI - Digital Object Identifier
<a href="http://dx.doi.org/10.1016/j.jics.2025.102177" target="_blank" >10.1016/j.jics.2025.102177</a>

Result language
angličtina
Original language name
New molecular hybrids of spirochromanone and carbamide: Design, synthesis, docking and in vitro anticancer studies
Original language description
Among the array of heterocyclic compounds with biological importance, spirochromanone has proven to be a potential pharmacophore embedded in many drug molecules. Herein, we report the design and synthesis of a series of novel molecular hybrids of carbamide and spirochromanone using a convenient three-step synthesis with good yields. All derivatives were screened for their cytotoxic activity using in vitro methods against cancer and non-cancerous cell lines, such as A549, HCT116, U2OS, Jurkat, CCRF-CEM, MOLT-4, RAMOS, K562, MRC-5 and BJ. Among all the screened compounds, C-06-2 was found to be more potent against MOLT-4 with an inhibition value of 45.57 f 7.56 mu M. Additionally, the C-06 series exhibited effective cytotoxicity against Jurkat and CCRF-CEM cell lines with an inhibition value of 23.18 f 4.20 to 41.43 f 7.18 mu M. Among the twelve compounds, C-05-2, C-06-2 have the best docking scores of-9.3 and-8.8 kcal/mol, respectively against ITK. The C-06 series showed more than-10 kcal/mol dock score against BTK.
Czech name
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Czech description
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Type
J<sub>imp</sub> - Article in a specialist periodical, which is included in the Web of Science database
CEP classification
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OECD FORD branch
30107 - Medicinal chemistry

Project
Result was created during the realization of more than one project. More information in the Projects tab.
Continuities
P - Projekt vyzkumu a vyvoje financovany z verejnych zdroju (s odkazem do CEP)

Publication year
2025
Confidentiality
S - Úplné a pravdivé údaje o projektu nepodléhají ochraně podle zvláštních právních předpisů

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