TL;DR: 1-[4-(1H-benzimidazol-2-ylmethoxy)phenyl]ethanone (CAS 118597-19-6) is a chemical compound with molecular formula C16H14N2O2 and molecular weight 266.10553 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[4-(1H-benzimidazol-2-ylmethoxy)phenyl]ethanone
Also Known As: 1-[4-(1H-benzimidazol-2-ylmethoxy)phenyl]ethanone, 1-(4-((1H-Benzo[d]imidazol-2-yl)methoxy)phenyl)ethanone, 1-[4-(1H-1,3-benzodiazol-2-ylmethoxy)phenyl]ethanone, AE-848/13008399, 1-[4-(1H-benzoimidazol-2-ylmethoxy)phenyl]ethanone
| Molecular Formula | C16H14N2O2 |
| Molecular Weight | 266.10553 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 55.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 266.10553 Da |
| Heavy Atoms | 20 |
| Complexity | 339.0 |
| SMILES | CC(=O)C1=CC=C(C=C1)OCC2=NC3=CC=CC=C3N2 |
| InChIKey | BBWDXHPXLNPMPZ-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[4-(1H-benzimidazol-2-ylmethoxy)phenyl]ethanone. With a topological polar surface area (TPSA) of 55.0 Ų, 1-[4-(1H-benzimidazol-2-ylmethoxy)phenyl]ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[4-(1H-benzimidazol-2-ylmethoxy)phenyl]ethanone has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-[4-(1H-benzimidazol-2-ylmethoxy)phenyl]ethanone is 118597-19-6.
The molecular formula of 1-[4-(1H-benzimidazol-2-ylmethoxy)phenyl]ethanone is C16H14N2O2.
The molecular weight of 1-[4-(1H-benzimidazol-2-ylmethoxy)phenyl]ethanone is 266.10553 g/mol.
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