TL;DR: Benzamide, 2-hydroxy-3-(1-(1H-imidazol-4-yl)ethyl)-, monohydrochloride, (+)- (CAS 127170-77-8) is a chemical compound with molecular formula C12H14ClN3O2 and molecular weight 267.07745 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-hydroxy-3-[(1S)-1-(1H-imidazol-5-yl)ethyl]benzamide;hydrochloride
Also Known As: Benzamide, 2-hydroxy-3-(1-(1H-imidazol-4-yl)ethyl)-, monohydrochloride, (+)-, (+)-2-Hydroxy-3-(1-(1H-imidazol-4-yl)ethyl)benzamide monohydrochloride, 2-hydroxy-3-[(1S)-1-(1H-imidazol-5-yl)ethyl]benzamide hydrochloride, Benzamide, 2-hydroxy-3-(1-(1H-imidazol-4-yl)ethyl)-, monohydrochloride, 2-Hydroxy-3-[(1S)-1-(1H-imidazol-5-yl)ethyl]benzamide--hydrogen chloride (1/1)
| Molecular Formula | C12H14ClN3O2 |
| Molecular Weight | 267.07745 g/mol |
| XLogP | 1.7878 |
| Topological Polar Surface Area (TPSA) | 92.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.07745 Da |
| Heavy Atoms | 18 |
| Complexity | 285.0 |
| SMILES | C[C@@H](C1=C(C(=CC=C1)C(=O)N)O)C2=CN=CN2.Cl |
| InChIKey | GFKLCFADQUYTTR-FJXQXJEOSA-N |
The XLogP value of 1.7878 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzamide, 2-hydroxy-3-(1-(1H-imidazol-4-yl)ethyl)-, monohydrochloride, (+)-. The TPSA of 92.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzamide, 2-hydroxy-3-(1-(1H-imidazol-4-yl)ethyl)-, monohydrochloride, (+)-. Following Lipinski's Rule of Five, Benzamide, 2-hydroxy-3-(1-(1H-imidazol-4-yl)ethyl)-, monohydrochloride, (+)- has 4 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 Benzamide, 2-hydroxy-3-(1-(1H-imidazol-4-yl)ethyl)-, monohydrochloride, (+)- is 127170-77-8.
The molecular formula of Benzamide, 2-hydroxy-3-(1-(1H-imidazol-4-yl)ethyl)-, monohydrochloride, (+)- is C12H14ClN3O2.
The molecular weight of Benzamide, 2-hydroxy-3-(1-(1H-imidazol-4-yl)ethyl)-, monohydrochloride, (+)- is 267.07745 g/mol.
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