TL;DR: Etilefrine Hydrochloride (CAS 10128-36-6) is a chemical compound with molecular formula C10H16ClNO2 and molecular weight 217.08696 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[2-(ethylamino)-1-hydroxyethyl]phenol;hydrochloride
Also Known As: etilefrine hydrochloride, Circupon, Effontil, Etilefrin Hydrochloride, Kertasin
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C10H16ClNO2 |
| Molecular Weight | 217.08696 g/mol |
| XLogP | 1.4569 |
| Topological Polar Surface Area (TPSA) | 57.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 217.08696 Da |
| Heavy Atoms | 14 |
| Complexity | 141.0 |
| SMILES | CCNCC(C1=CC(=CC=C1)O)O.Cl |
| InChIKey | KTNROWWHOBZQGK-UHFFFAOYSA-N |
The XLogP value of 1.4569 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Etilefrine Hydrochloride. With a topological polar surface area (TPSA) of 57.1 Ų, Etilefrine Hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Etilefrine 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 Etilefrine Hydrochloride is 10128-36-6.
The molecular formula of Etilefrine Hydrochloride is C10H16ClNO2.
The molecular weight of Etilefrine Hydrochloride is 217.08696 g/mol.
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