1-Methyl-4-phenylpiperidine-3,4-diol
TL;DR: 1-Methyl-4-phenylpiperidine-3,4-diol (CAS 1891-20-9) is a chemical compound with molecular formula C12H17NO2 and molecular weight 207.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-4-phenylpiperidine-3,4-diol
Also Known As: 1-methyl-4-phenylpiperidine-3,4-diol, 1-methyl-4-phenyl-piperidine-3,4-diol
| Molecular Formula | C12H17NO2 |
|---|---|
| Molecular Weight | 207.13 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 43.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 207.12593 |
| Heavy Atoms | 15 |
| Complexity | 216.0 |
Chemical Identifiers
| CAS Number | 1891-20-9 |
|---|---|
| SMILES | CN1CCC(C(C1)O)(C2=CC=CC=C2)O |
| InChIKey | HAATVDDNXGDFHD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methyl-4-phenylpiperidine-3,4-diol (CAS 1891-20-9), with molecular formula C12H17NO2 and molecular weight 207.13 g/mol. IUPAC: 1-methyl-4-phenylpiperidine-3,4-diol.
Chemical Property Profile of 1-Methyl-4-phenylpiperidine-3,4-diol
Property Insights of 1-Methyl-4-phenylpiperidine-3,4-diol
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-4-phenylpiperidine-3,4-diol. With a topological polar surface area (TPSA) of 43.7 Ų, 1-Methyl-4-phenylpiperidine-3,4-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Methyl-4-phenylpiperidine-3,4-diol 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-Methyl-4-phenylpiperidine-3,4-diol?
The CAS number of 1-Methyl-4-phenylpiperidine-3,4-diol is 1891-20-9.
What is the molecular formula of 1-Methyl-4-phenylpiperidine-3,4-diol?
The molecular formula of 1-Methyl-4-phenylpiperidine-3,4-diol is C12H17NO2.
What is the molecular weight of 1-Methyl-4-phenylpiperidine-3,4-diol?
The molecular weight of 1-Methyl-4-phenylpiperidine-3,4-diol is 207.13 g/mol.
Where can I buy 1-Methyl-4-phenylpiperidine-3,4-diol?
You can request a quote for 1-Methyl-4-phenylpiperidine-3,4-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-4-phenylpiperidine-3,4-diol?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-4-phenylpiperidine-3,4-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.