Information card for entry 7248496

Structure parameters

• Chemical name: (10H-phenothiazin-2-yl)(2-phenylimidazo[1,2-a]pyridin-3-yl)methanone
• Formula: C26 H17.67 N3 O1.33 S
• Calculated formula: C26 H17.6667 N3 O1.33333 S
• SMILES: S1c2c(Nc3c1cccc3)cc(C(=O)c1n3c(nc1c1ccccc1)cccc3)cc2.O
• Title of publication: Design, synthesis, molecular docking and anti-proliferative activity of novel phenothiazine containing imidazo[1,2-a]pyridine derivatives against MARK4 protein
• Authors of publication: Bhakta, Avijit; Mukhtar, Sayeed; Anwar, Saleha; Haider, Shaista; Alahmdi, Mohammed Issa; Parveen, Humaira; Alsharif, Meshari A.; Wani, Mohmmad Younus; Chakrabarty, Anindita; Hassan, Md. Imtaiyaz; Ahmed, Naseem
• Journal of publication: RSC Medicinal Chemistry
• Year of publication: 2024
• a: 12.19 ± 0.0006 Å
• b: 33.234 ± 0.0016 Å
• c: 16.193 ± 0.0008 Å
• α: 90°
• β: 93.071 ± 0.001°
• γ: 90°
• Cell volume: 6550.7 ± 0.6 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0825
• Residual factor for significantly intense reflections: 0.0546
• Weighted residual factors for significantly intense reflections: 0.122
• Weighted residual factors for all reflections included in the refinement: 0.1343
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No