4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-3-equatorial-methyl-6-equatorial-phenyl-, hydrochloride
TL;DR: 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-3-equatorial-methyl-6-equatorial-phenyl-, hydrochloride (CAS 66439-99-4) is a chemical compound with molecular formula C19H22ClNO2 and molecular weight 331.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,5S)-1-benzyl-5-hydroxy-5-methyl-2-phenylpiperidin-4-one;hydrochloride
Also Known As: 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-3-equatorial-methyl-6-equatorial-phenyl-, hydrochloride, (2S,5S)-1-benzyl-5-hydroxy-5-methyl-2-phenylpiperidin-4-one hydrochloride, (2S,5S)-1-benzyl-5-hydroxy-5-methyl-2-phenyl-piperidin-4-one Hydrochloride, (2S,5S)-1-Benzyl-5-hydroxy-5-methyl-2-phenylpiperidin-4-one--hydrogen chloride (1/1), RefChem:295934
| Molecular Formula | C19H22ClNO2 |
|---|---|
| Molecular Weight | 331.13 g/mol |
| LogP | 3.3755 |
| Topological Polar Surface Area | 40.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 331.1339 |
| Heavy Atoms | 23 |
| Complexity | 642.9339 |
Chemical Identifiers
| CAS Number | 66439-99-4 |
|---|---|
| SMILES | C[C@@]1(CN([C@@H](CC1=O)C2=CC=CC=C2)CC3=CC=CC=C3)O.Cl |
Product Overview
4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-3-equatorial-methyl-6-equatorial-phenyl-, hydrochloride (CAS 66439-99-4), with molecular formula C19H22ClNO2 and molecular weight 331.13 g/mol. IUPAC: (2S,5S)-1-benzyl-5-hydroxy-5-methyl-2-phenylpiperidin-4-one;hydrochloride.
Chemical Property Profile of 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-3-equatorial-methyl-6-equatorial-phenyl-, hydrochloride
Property Insights of 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-3-equatorial-methyl-6-equatorial-phenyl-, hydrochloride
The XLogP value of 3.3755 indicates that 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-3-equatorial-methyl-6-equatorial-phenyl-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.54 Ų, 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-3-equatorial-methyl-6-equatorial-phenyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-3-equatorial-methyl-6-equatorial-phenyl-, hydrochloride has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-3-equatorial-methyl-6-equatorial-phenyl-, hydrochloride?
The CAS number of 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-3-equatorial-methyl-6-equatorial-phenyl-, hydrochloride is 66439-99-4.
What is the molecular formula of 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-3-equatorial-methyl-6-equatorial-phenyl-, hydrochloride?
The molecular formula of 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-3-equatorial-methyl-6-equatorial-phenyl-, hydrochloride is C19H22ClNO2.
What is the molecular weight of 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-3-equatorial-methyl-6-equatorial-phenyl-, hydrochloride?
The molecular weight of 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-3-equatorial-methyl-6-equatorial-phenyl-, hydrochloride is 331.13 g/mol.
Where can I buy 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-3-equatorial-methyl-6-equatorial-phenyl-, hydrochloride?
You can request a quote for 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-3-equatorial-methyl-6-equatorial-phenyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-3-equatorial-methyl-6-equatorial-phenyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-3-equatorial-methyl-6-equatorial-phenyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.