TL;DR: RefChem:1061605 (CAS 102371-05-1) is a chemical compound with molecular formula C20H32ClNO3 and molecular weight 369.20706 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(diethylamino)ethyl 2-(1-hydroxycyclohexyl)-2-phenylacetate;hydrochloride
Also Known As: 2-Diethylaminoethyl alpha-phenyl-alpha-(1-hydroxycyclohexyl)acetate hydrochloride, 1-Hydroxy-alpha-phenylcyclohexaneacetic acid (2-(diethylamino)ethyl) ester hydrochloride, Cyclohexaneacetic acid, 1-hydroxy-alpha-phenyl-, (2-(diethylamino)ethyl) ester, hydrochloride, 2-(Diethylamino)ethyl (1-hydroxycyclohexyl)(phenyl)acetate--hydrogen chloride (1/1), 2-diethylaminoethyl 2-(1-hydroxycyclohexyl)-2-phenylacetate hydrochloride
| Molecular Formula | C20H32ClNO3 |
| Molecular Weight | 369.20706 g/mol |
| XLogP | 3.7722 |
| Topological Polar Surface Area (TPSA) | 49.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 369.20706 Da |
| Heavy Atoms | 25 |
| Complexity | 369.0 |
| SMILES | CCN(CC)CCOC(=O)C(C1=CC=CC=C1)C2(CCCCC2)O.Cl |
| InChIKey | PSEGRWXXDZTXRG-UHFFFAOYSA-N |
The XLogP value of 3.7722 indicates that RefChem:1061605 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.8 Ų, RefChem:1061605 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1061605 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of RefChem:1061605 is 102371-05-1.
The molecular formula of RefChem:1061605 is C20H32ClNO3.
The molecular weight of RefChem:1061605 is 369.20706 g/mol.
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