4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-6-equatorial-(p-methoxyphenyl)-3-equatorial-methyl-, hydrochloride
TL;DR: 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-6-equatorial-(p-methoxyphenyl)-3-equatorial-methyl-, hydrochloride (CAS 66440-00-4) is a chemical compound with molecular formula C20H24ClNO3 and molecular weight 361.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,5S)-1-benzyl-5-hydroxy-2-(4-methoxyphenyl)-5-methylpiperidin-4-one;hydrochloride
Also Known As: 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-6-equatorial-(p-methoxyphenyl)-3-equatorial-methyl-, hydrochloride, (2S,5S)-1-benzyl-5-hydroxy-2-(4-methoxyphenyl)-5-methyl-piperidin-4-one Hydrochloride, (2S,5S)-1-benzyl-5-hydroxy-2-(4-methoxyphenyl)-5-methylpiperidin-4-one hydrochloride, (2S,5S)-1-Benzyl-5-hydroxy-2-(4-methoxyphenyl)-5-methylpiperidin-4-one--hydrogen chloride (1/1), RefChem:295935
| Molecular Formula | C20H24ClNO3 |
|---|---|
| Molecular Weight | 361.14 g/mol |
| LogP | 3.3841 |
| Topological Polar Surface Area | 49.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 361.14447 |
| Heavy Atoms | 25 |
| Complexity | 700.64105 |
Chemical Identifiers
| CAS Number | 66440-00-4 |
|---|---|
| SMILES | C[C@@]1(CN([C@@H](CC1=O)C2=CC=C(C=C2)OC)CC3=CC=CC=C3)O.Cl |
Product Overview
4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-6-equatorial-(p-methoxyphenyl)-3-equatorial-methyl-, hydrochloride (CAS 66440-00-4), with molecular formula C20H24ClNO3 and molecular weight 361.14 g/mol. IUPAC: (2S,5S)-1-benzyl-5-hydroxy-2-(4-methoxyphenyl)-5-methylpiperidin-4-one;hydrochloride.
Chemical Property Profile of 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-6-equatorial-(p-methoxyphenyl)-3-equatorial-methyl-, hydrochloride
Property Insights of 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-6-equatorial-(p-methoxyphenyl)-3-equatorial-methyl-, hydrochloride
The XLogP value of 3.3841 indicates that 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-6-equatorial-(p-methoxyphenyl)-3-equatorial-methyl-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.77 Ų, 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-6-equatorial-(p-methoxyphenyl)-3-equatorial-methyl-, 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-6-equatorial-(p-methoxyphenyl)-3-equatorial-methyl-, hydrochloride has 1 hydrogen bond donor(s) and 4 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-6-equatorial-(p-methoxyphenyl)-3-equatorial-methyl-, hydrochloride?
The CAS number of 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-6-equatorial-(p-methoxyphenyl)-3-equatorial-methyl-, hydrochloride is 66440-00-4.
What is the molecular formula of 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-6-equatorial-(p-methoxyphenyl)-3-equatorial-methyl-, hydrochloride?
The molecular formula of 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-6-equatorial-(p-methoxyphenyl)-3-equatorial-methyl-, hydrochloride is C20H24ClNO3.
What is the molecular weight of 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-6-equatorial-(p-methoxyphenyl)-3-equatorial-methyl-, hydrochloride?
The molecular weight of 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-6-equatorial-(p-methoxyphenyl)-3-equatorial-methyl-, hydrochloride is 361.14 g/mol.
Where can I buy 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-6-equatorial-(p-methoxyphenyl)-3-equatorial-methyl-, hydrochloride?
You can request a quote for 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-6-equatorial-(p-methoxyphenyl)-3-equatorial-methyl-, 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-6-equatorial-(p-methoxyphenyl)-3-equatorial-methyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 4-Piperidone, 1-equatorial-benzyl-3-axial-hydroxy-6-equatorial-(p-methoxyphenyl)-3-equatorial-methyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.