TL;DR: 4-(6-Chloro-1H-benzo[d]imidazol-2-yl)phenol (CAS 113561-60-7) is a chemical compound with molecular formula C13H9ClN2O and molecular weight 244.04034 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(6-chloro-1H-benzimidazol-2-yl)phenol
Also Known As: 2-(4-hydroxyphenyl)-5-chlorobenzimidazole, 4-(6-Chloro-1H-benzo[d]imidazol-2-yl)phenol, 4-(5-Chloro-1H-benzimidazol-2-yl)phenol, Phenol, 4-(5-chloro-1H-benzimidazol-2-yl)-, 4-(6-chloro-1H-benzimidazol-2-yl)phenol
| Molecular Formula | C13H9ClN2O |
| Molecular Weight | 244.04034 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 48.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 244.04034 Da |
| Heavy Atoms | 17 |
| Complexity | 268.0 |
| SMILES | C1=CC(=CC=C1C2=NC3=C(N2)C=C(C=C3)Cl)O |
| InChIKey | GGUHTGJGVJGBEI-UHFFFAOYSA-N |
The XLogP value of 3.5 indicates that 4-(6-Chloro-1H-benzo[d]imidazol-2-yl)phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 48.9 Ų, 4-(6-Chloro-1H-benzo[d]imidazol-2-yl)phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(6-Chloro-1H-benzo[d]imidazol-2-yl)phenol has 2 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 4-(6-Chloro-1H-benzo[d]imidazol-2-yl)phenol is 113561-60-7.
The molecular formula of 4-(6-Chloro-1H-benzo[d]imidazol-2-yl)phenol is C13H9ClN2O.
The molecular weight of 4-(6-Chloro-1H-benzo[d]imidazol-2-yl)phenol is 244.04034 g/mol.
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