Information card for entry 7246991

Structure parameters

• Chemical name: N-(2-methylphenyl)-5-phenyl-1,3,4-oxadiazol-2-amine
• Formula: C15 H13 N3 O
• Calculated formula: C15 H13 N3 O
• SMILES: o1c(Nc2c(C)cccc2)nnc1c1ccccc1
• Title of publication: Therapeutic potential of 1,3,4-oxadiazoles as potential lead compounds for the treatment of Alzheimer's disease.
• Authors of publication: Naseem, Saira; Temirak, Ahmed; Imran, Aqeel; Jalil, Saquib; Fatima, Shamool; Taslimi, Parham; Iqbal, Jamshed; Tasleem, Mussarat; Tahir, Muhammad Nawaz; Shafiq, Zahid
• Journal of publication: RSC advances
• Year of publication: 2023
• Journal volume: 13
• Journal issue: 26
• Pages of publication: 17526 - 17535
• a: 8.5156 ± 0.0016 Å
• b: 7.2615 ± 0.0015 Å
• c: 20.971 ± 0.004 Å
• α: 90°
• β: 93.424 ± 0.009°
• γ: 90°
• Cell volume: 1294.4 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• 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: 0.0699
• Residual factor for significantly intense reflections: 0.0545
• Weighted residual factors for significantly intense reflections: 0.147
• Weighted residual factors for all reflections included in the refinement: 0.16
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No