Information card for entry 7243280

Structure parameters

• Formula: C25 H18 F2 N2 O3
• Calculated formula: C25 H18 F2 N2 O3
• SMILES: c1(ccc(cc1)F)C(=NNC(=O)/C=C/C=C/c1ccc2c(c1)OCO2)c1ccc(cc1)F
• Title of publication: Structure-based design, synthesis, and biological evaluation of novel piperine‒resveratrol hybrids as antiproliferative agents targeting SIRT-2
• Authors of publication: Tantawy, Ahmed H.; Meng, Xiang-Gao; Marzouk, Adel A.; Fouad, Ali; Abdelazeem, Ahmed H.; Youssif, Bahaa G. M.; Jiang, Hong; Wang, Man-Qun
• Journal of publication: RSC Advances
• Year of publication: 2021
• Journal volume: 11
• Journal issue: 41
• Pages of publication: 25738 - 25751
• a: 5.329 ± 0.003 Å
• b: 10.708 ± 0.005 Å
• c: 15.496 ± 0.007 Å
• α: 83.878 ± 0.009°
• β: 87.608 ± 0.009°
• γ: 82.24 ± 0.009°
• Cell volume: 870.8 ± 0.7 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0965
• Residual factor for significantly intense reflections: 0.0623
• Weighted residual factors for significantly intense reflections: 0.169
• Weighted residual factors for all reflections included in the refinement: 0.1941
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No