TL;DR: Propiophenone, 4'-isopentyloxy-3-piperidino-, hydrochloride (CAS 63957-30-2) is a chemical compound with molecular formula C19H30ClNO2 and molecular weight 339.1965 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[4-(3-methylbutoxy)phenyl]-3-piperidin-1-ylpropan-1-one;hydrochloride
Also Known As: Propiophenone, 4'-isopentyloxy-3-piperidino-, hydrochloride, KST-1B6982, 4-Isopentyloxy-beta-(1-piperidyl)propiophenone hydrochloride, 1-[4-(3-methylbutoxy)phenyl]-3-(piperidin-1-yl)propan-1-onehydrochloride(1:1), 1-[4-(3-methylbutoxy)phenyl]-3-piperidin-1-ylpropan-1-one;hydrochloride
| Molecular Formula | C19H30ClNO2 |
| Molecular Weight | 339.1965 g/mol |
| XLogP | 4.59 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 339.1965 Da |
| Heavy Atoms | 23 |
| Complexity | 315.0 |
| SMILES | CC(C)CCOC1=CC=C(C=C1)C(=O)CCN2CCCCC2.Cl |
| InChIKey | AAQRTKVNHBMDLP-UHFFFAOYSA-N |
The XLogP value of 4.59 indicates that Propiophenone, 4'-isopentyloxy-3-piperidino-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Propiophenone, 4'-isopentyloxy-3-piperidino-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propiophenone, 4'-isopentyloxy-3-piperidino-, hydrochloride 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 Propiophenone, 4'-isopentyloxy-3-piperidino-, hydrochloride is 63957-30-2.
The molecular formula of Propiophenone, 4'-isopentyloxy-3-piperidino-, hydrochloride is C19H30ClNO2.
The molecular weight of Propiophenone, 4'-isopentyloxy-3-piperidino-, hydrochloride is 339.1965 g/mol.
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