TL;DR: Ethanone, 1-(2-phenyl-1H-benzimidazol-5-yl)- (CAS 91437-90-0) is a chemical compound with molecular formula C15H12N2O and molecular weight 236.09496 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-phenyl-3H-benzimidazol-5-yl)ethanone
Also Known As: 1-(2-Phenyl-1H-benzimidazol-5-yl)ethanone, ETHANONE, 1-(2-PHENYL-1H-BENZIMIDAZOL-5-YL)-, 1-(2-phenyl-3H-benzimidazol-5-yl)ethanone, 1-(2-Phenyl-1H-1,3-benzimidazol-6-yl)ethan-1-one
| Molecular Formula | C15H12N2O |
| Molecular Weight | 236.09496 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 45.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.09496 Da |
| Heavy Atoms | 18 |
| Complexity | 312.0 |
| SMILES | CC(=O)C1=CC2=C(C=C1)N=C(N2)C3=CC=CC=C3 |
| InChIKey | ZACVEKOHHBZAQJ-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 1-(2-phenyl-1H-benzimidazol-5-yl)-. With a topological polar surface area (TPSA) of 45.8 Ų, Ethanone, 1-(2-phenyl-1H-benzimidazol-5-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanone, 1-(2-phenyl-1H-benzimidazol-5-yl)- has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Ethanone, 1-(2-phenyl-1H-benzimidazol-5-yl)- is 91437-90-0.
The molecular formula of Ethanone, 1-(2-phenyl-1H-benzimidazol-5-yl)- is C15H12N2O.
The molecular weight of Ethanone, 1-(2-phenyl-1H-benzimidazol-5-yl)- is 236.09496 g/mol.
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