TL;DR: 1-(Benzo -2-(1- ethanolhydrochloride (CAS 142934-83-6) is a chemical compound with molecular formula C18H19ClN2O3S and molecular weight 378.0805 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[2-[2-(1-benzothiophen-5-yl)-2-hydroxyethoxy]ethyl]pyridine-2-carboxamide;hydrochloride
Also Known As: 1-(Benzo -2-(1- ethanolhydrochloride, N-(2-(2-Benzo(b)thien-5-yl-2-hydroxyethoxy)ethyl)-2-pyridinecarboxamide monohydrochloride, 1-(Benzo(b)thiophen-5-yl)-2-(1-(nicotinoylamino)ethoxy)ethanol hydrochloride, 2-Pyridinecarboxamide, N-(2-(2-benzo(b)thien-5-yl-2-hydroxyethoxy)ethyl)-, monohydrochloride, N-[2-[2-(1-benzothiophen-5-yl)-2-hydroxyethoxy]ethyl]pyridine-2-carboxamide;hydrochloride
| Molecular Formula | C18H19ClN2O3S |
| Molecular Weight | 378.0805 g/mol |
| XLogP | 3.1981 |
| Topological Polar Surface Area (TPSA) | 99.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 378.0805 Da |
| Heavy Atoms | 25 |
| Complexity | 410.0 |
| SMILES | C1=CC=NC(=C1)C(=O)NCCOCC(C2=CC3=C(C=C2)SC=C3)O.Cl |
| InChIKey | BGFWPEONHRVPHS-UHFFFAOYSA-N |
The XLogP value of 3.1981 indicates that 1-(Benzo -2-(1- ethanolhydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Benzo -2-(1- ethanolhydrochloride. Following Lipinski's Rule of Five, 1-(Benzo -2-(1- ethanolhydrochloride has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-(Benzo -2-(1- ethanolhydrochloride is 142934-83-6.
The molecular formula of 1-(Benzo -2-(1- ethanolhydrochloride is C18H19ClN2O3S.
The molecular weight of 1-(Benzo -2-(1- ethanolhydrochloride is 378.0805 g/mol.
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