1,3-Dimethyl-3-alpha,4-beta-piperidinediol hydrochloride
TL;DR: 1,3-Dimethyl-3-alpha,4-beta-piperidinediol hydrochloride (CAS 67261-56-7) is a chemical compound with molecular formula C13H19Cl2NO2 and molecular weight 291.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S,4S,6S)-6-(4-chlorophenyl)-1,3-dimethylpiperidine-3,4-diol;hydrochloride
Also Known As: 1,3-Dimethyl-3-alpha,4-beta-piperidinediol hydrochloride, 3,4-Piperidinediol, 6-(4-chlorophenyl)-1,3-dimethyl-, hydrochloride, (3-alpha,4-beta,6-beta)-, (3S,4S,6S)-6-(4-chlorophenyl)-1,3-dimethylpiperidine-3,4-diol hydrochloride, (3S,4S,6S)-6-(4-Chlorophenyl)-1,3-dimethylpiperidine-3,4-diol--hydrogen chloride (1/1), RefChem:271311
| Molecular Formula | C13H19Cl2NO2 |
|---|---|
| Molecular Weight | 291.08 g/mol |
| LogP | 2.2503 |
| Topological Polar Surface Area | 43.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 291.07928 |
| Heavy Atoms | 18 |
| Complexity | 394.48264 |
Chemical Identifiers
| CAS Number | 67261-56-7 |
|---|---|
| SMILES | C[C@@]1(CN([C@@H](C[C@@H]1O)C2=CC=C(C=C2)Cl)C)O.Cl |
Product Overview
1,3-Dimethyl-3-alpha,4-beta-piperidinediol hydrochloride (CAS 67261-56-7), with molecular formula C13H19Cl2NO2 and molecular weight 291.08 g/mol. IUPAC: (3S,4S,6S)-6-(4-chlorophenyl)-1,3-dimethylpiperidine-3,4-diol;hydrochloride.
Chemical Property Profile of 1,3-Dimethyl-3-alpha,4-beta-piperidinediol hydrochloride
Property Insights of 1,3-Dimethyl-3-alpha,4-beta-piperidinediol hydrochloride
The XLogP value of 2.2503 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dimethyl-3-alpha,4-beta-piperidinediol hydrochloride. With a topological polar surface area (TPSA) of 43.7 Ų, 1,3-Dimethyl-3-alpha,4-beta-piperidinediol hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dimethyl-3-alpha,4-beta-piperidinediol hydrochloride has 2 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 1,3-Dimethyl-3-alpha,4-beta-piperidinediol hydrochloride?
The CAS number of 1,3-Dimethyl-3-alpha,4-beta-piperidinediol hydrochloride is 67261-56-7.
What is the molecular formula of 1,3-Dimethyl-3-alpha,4-beta-piperidinediol hydrochloride?
The molecular formula of 1,3-Dimethyl-3-alpha,4-beta-piperidinediol hydrochloride is C13H19Cl2NO2.
What is the molecular weight of 1,3-Dimethyl-3-alpha,4-beta-piperidinediol hydrochloride?
The molecular weight of 1,3-Dimethyl-3-alpha,4-beta-piperidinediol hydrochloride is 291.08 g/mol.
Where can I buy 1,3-Dimethyl-3-alpha,4-beta-piperidinediol hydrochloride?
You can request a quote for 1,3-Dimethyl-3-alpha,4-beta-piperidinediol hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dimethyl-3-alpha,4-beta-piperidinediol hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dimethyl-3-alpha,4-beta-piperidinediol hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.