TL;DR: 1-(1H-benzo[d]imidazol-2-yl)-3-phenyl-1H-pyrazol-5-ol hydrochloride (CAS 1185479-15-5) is a chemical compound with molecular formula C16H13ClN4O and molecular weight 312.0778 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(1H-benzimidazol-2-yl)-5-phenyl-1H-pyrazol-3-one;hydrochloride
Also Known As: 1-(1H-benzo[d]imidazol-2-yl)-3-phenyl-1H-pyrazol-5-ol hydrochloride, 2-(1H-benzimidazol-2-yl)-5-phenyl-1H-pyrazol-3-one hydrochloride, 2-(1H-benzoimidazol-2-yl)-5-phenyl-1,2-dihydropyrazol-3-one hydrochloride salt
| Molecular Formula | C16H13ClN4O |
| Molecular Weight | 312.0778 g/mol |
| XLogP | 3.1307 |
| Topological Polar Surface Area (TPSA) | 61.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 312.0778 Da |
| Heavy Atoms | 22 |
| Complexity | 444.0 |
| SMILES | C1=CC=C(C=C1)C2=CC(=O)N(N2)C3=NC4=CC=CC=C4N3.Cl |
| InChIKey | LBTFWRHQLDKVRN-UHFFFAOYSA-N |
The XLogP value of 3.1307 indicates that 1-(1H-benzo[d]imidazol-2-yl)-3-phenyl-1H-pyrazol-5-ol hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1H-benzo[d]imidazol-2-yl)-3-phenyl-1H-pyrazol-5-ol hydrochloride. Following Lipinski's Rule of Five, 1-(1H-benzo[d]imidazol-2-yl)-3-phenyl-1H-pyrazol-5-ol hydrochloride has 3 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-(1H-benzo[d]imidazol-2-yl)-3-phenyl-1H-pyrazol-5-ol hydrochloride is 1185479-15-5.
The molecular formula of 1-(1H-benzo[d]imidazol-2-yl)-3-phenyl-1H-pyrazol-5-ol hydrochloride is C16H13ClN4O.
The molecular weight of 1-(1H-benzo[d]imidazol-2-yl)-3-phenyl-1H-pyrazol-5-ol hydrochloride is 312.0778 g/mol.
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