TL;DR: 2-{Benzyl[2-(benzyloxy)ethyl]amino}ethanol (CAS 113618-73-8) is a chemical compound with molecular formula C18H23NO2 and molecular weight 285.17288 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[benzyl(2-phenylmethoxyethyl)amino]ethanol
Also Known As: BAS 00104526, 2-{benzyl[2-(benzyloxy)ethyl]amino}ethanol, 2-[benzyl(2-phenylmethoxyethyl)amino]ethanol, 2-[Benzyl-(2-benzyloxy-ethyl)-amino]-ethanol, 2-(Benzyl(2-(benzyloxy)ethyl)amino)ethan-1-ol
| Molecular Formula | C18H23NO2 |
| Molecular Weight | 285.17288 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 32.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 285.17288 Da |
| Heavy Atoms | 21 |
| Complexity | 248.0 |
| SMILES | C1=CC=C(C=C1)CN(CCO)CCOCC2=CC=CC=C2 |
| InChIKey | DZOHSMSGNGPWCO-UHFFFAOYSA-N |
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{Benzyl[2-(benzyloxy)ethyl]amino}ethanol. With a topological polar surface area (TPSA) of 32.7 Ų, 2-{Benzyl[2-(benzyloxy)ethyl]amino}ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{Benzyl[2-(benzyloxy)ethyl]amino}ethanol has 1 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 2-{Benzyl[2-(benzyloxy)ethyl]amino}ethanol is 113618-73-8.
The molecular formula of 2-{Benzyl[2-(benzyloxy)ethyl]amino}ethanol is C18H23NO2.
The molecular weight of 2-{Benzyl[2-(benzyloxy)ethyl]amino}ethanol is 285.17288 g/mol.
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