TL;DR: Phosphine oxide, diethyl((alpha-(2-piperidino)ethyl)benzyl)-, hydrochloride (CAS 51713-23-6) is a chemical compound with molecular formula C18H31ClNOP and molecular weight 343.18317 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3-diethylphosphoryl-3-phenylpropyl)piperidine;hydrochloride
Also Known As: KST-1B4863, (1-Phenyl-3-piperidinopropyl)diethylphosphine oxide hydrochloride, Phosphine oxide, diethyl((1-phenyl-3-piperidino)propyl)-, hydrochloride, Phosphine oxide, diethyl((alpha-(2-piperidino)ethyl)benzyl)-, hydrochloride, 1-[3-(diethylphosphoryl)-3-phenylpropyl]piperidine hydrochloride(1:1)
| Molecular Formula | C18H31ClNOP |
| Molecular Weight | 343.18317 g/mol |
| XLogP | 5.43 |
| Topological Polar Surface Area (TPSA) | 20.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 343.18317 Da |
| Heavy Atoms | 22 |
| Complexity | 324.0 |
| SMILES | CCP(=O)(CC)C(CCN1CCCCC1)C2=CC=CC=C2.Cl |
| InChIKey | RMCJXUNUEWFXND-UHFFFAOYSA-N |
The XLogP value of 5.43 indicates that Phosphine oxide, diethyl((alpha-(2-piperidino)ethyl)benzyl)-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, Phosphine oxide, diethyl((alpha-(2-piperidino)ethyl)benzyl)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphine oxide, diethyl((alpha-(2-piperidino)ethyl)benzyl)-, hydrochloride has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Phosphine oxide, diethyl((alpha-(2-piperidino)ethyl)benzyl)-, hydrochloride is 51713-23-6.
The molecular formula of Phosphine oxide, diethyl((alpha-(2-piperidino)ethyl)benzyl)-, hydrochloride is C18H31ClNOP.
The molecular weight of Phosphine oxide, diethyl((alpha-(2-piperidino)ethyl)benzyl)-, hydrochloride is 343.18317 g/mol.
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