4-Piperidone, 1-equatorial,3-axial-dimethyl-6-equatorial-(o-fluorophenyl)-3-equatorial-hydroxy-, hydrochloride
TL;DR: 4-Piperidone, 1-equatorial,3-axial-dimethyl-6-equatorial-(o-fluorophenyl)-3-equatorial-hydroxy-, hydrochloride (CAS 66439-94-9) is a chemical compound with molecular formula C13H17ClFNO2 and molecular weight 273.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,5R)-2-(2-fluorophenyl)-5-hydroxy-1,5-dimethylpiperidin-4-one;hydrochloride
Also Known As: 4-Piperidone, 1-equatorial,3-axial-dimethyl-6-equatorial-(o-fluorophenyl)-3-equatorial-hydroxy-, hydrochloride, (2S,5R)-2-(2-fluorophenyl)-5-hydroxy-1,5-dimethyl-piperidin-4-one Hydrochloride, (2S,5R)-2-(2-fluorophenyl)-5-hydroxy-1,5-dimethylpiperidin-4-one hydrochloride, (2S,5R)-2-(2-Fluorophenyl)-5-hydroxy-1,5-dimethylpiperidin-4-one--hydrogen chloride (1/1), RefChem:295933
| Molecular Formula | C13H17ClFNO2 |
|---|---|
| Molecular Weight | 273.09 g/mol |
| LogP | 1.9442 |
| Topological Polar Surface Area | 40.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 273.09317 |
| Heavy Atoms | 18 |
| Complexity | 450.3723 |
Chemical Identifiers
| CAS Number | 66439-94-9 |
|---|---|
| SMILES | C[C@]1(CN([C@@H](CC1=O)C2=CC=CC=C2F)C)O.Cl |
Product Overview
4-Piperidone, 1-equatorial,3-axial-dimethyl-6-equatorial-(o-fluorophenyl)-3-equatorial-hydroxy-, hydrochloride (CAS 66439-94-9), with molecular formula C13H17ClFNO2 and molecular weight 273.09 g/mol. IUPAC: (2S,5R)-2-(2-fluorophenyl)-5-hydroxy-1,5-dimethylpiperidin-4-one;hydrochloride.
Chemical Property Profile of 4-Piperidone, 1-equatorial,3-axial-dimethyl-6-equatorial-(o-fluorophenyl)-3-equatorial-hydroxy-, hydrochloride
Property Insights of 4-Piperidone, 1-equatorial,3-axial-dimethyl-6-equatorial-(o-fluorophenyl)-3-equatorial-hydroxy-, hydrochloride
The XLogP value of 1.9442 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Piperidone, 1-equatorial,3-axial-dimethyl-6-equatorial-(o-fluorophenyl)-3-equatorial-hydroxy-, hydrochloride. With a topological polar surface area (TPSA) of 40.54 Ų, 4-Piperidone, 1-equatorial,3-axial-dimethyl-6-equatorial-(o-fluorophenyl)-3-equatorial-hydroxy-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Piperidone, 1-equatorial,3-axial-dimethyl-6-equatorial-(o-fluorophenyl)-3-equatorial-hydroxy-, 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,3-axial-dimethyl-6-equatorial-(o-fluorophenyl)-3-equatorial-hydroxy-, hydrochloride?
The CAS number of 4-Piperidone, 1-equatorial,3-axial-dimethyl-6-equatorial-(o-fluorophenyl)-3-equatorial-hydroxy-, hydrochloride is 66439-94-9.
What is the molecular formula of 4-Piperidone, 1-equatorial,3-axial-dimethyl-6-equatorial-(o-fluorophenyl)-3-equatorial-hydroxy-, hydrochloride?
The molecular formula of 4-Piperidone, 1-equatorial,3-axial-dimethyl-6-equatorial-(o-fluorophenyl)-3-equatorial-hydroxy-, hydrochloride is C13H17ClFNO2.
What is the molecular weight of 4-Piperidone, 1-equatorial,3-axial-dimethyl-6-equatorial-(o-fluorophenyl)-3-equatorial-hydroxy-, hydrochloride?
The molecular weight of 4-Piperidone, 1-equatorial,3-axial-dimethyl-6-equatorial-(o-fluorophenyl)-3-equatorial-hydroxy-, hydrochloride is 273.09 g/mol.
Where can I buy 4-Piperidone, 1-equatorial,3-axial-dimethyl-6-equatorial-(o-fluorophenyl)-3-equatorial-hydroxy-, hydrochloride?
You can request a quote for 4-Piperidone, 1-equatorial,3-axial-dimethyl-6-equatorial-(o-fluorophenyl)-3-equatorial-hydroxy-, 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,3-axial-dimethyl-6-equatorial-(o-fluorophenyl)-3-equatorial-hydroxy-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 4-Piperidone, 1-equatorial,3-axial-dimethyl-6-equatorial-(o-fluorophenyl)-3-equatorial-hydroxy-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.