Methyl 4-phenylpiperidine-4-carboxylate
TL;DR: Methyl 4-phenylpiperidine-4-carboxylate (CAS 54824-07-6) is a chemical compound with molecular formula C13H17NO2 and molecular weight 219.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-phenylpiperidine-4-carboxylate
Also Known As: methyl 4-phenylpiperidine-4-carboxylate, 4-Methoxycarbonyl-4-phenylpiperidine, 4 -methoxycarbonyl-4-phenylpiperidine, Methyl 4-phenyl-4-piperidinecarboxylate, 4-Phenyl-4-piperidinecarboxylic acid methyl ester
| Molecular Formula | C13H17NO2 |
|---|---|
| Molecular Weight | 219.13 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 219.12593 |
| Heavy Atoms | 16 |
| Complexity | 240.0 |
Chemical Identifiers
| CAS Number | 54824-07-6 |
|---|---|
| SMILES | COC(=O)C1(CCNCC1)C2=CC=CC=C2 |
| InChIKey | KUISDPUHRPZRFF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 4-phenylpiperidine-4-carboxylate (CAS 54824-07-6), with molecular formula C13H17NO2 and molecular weight 219.13 g/mol. IUPAC: methyl 4-phenylpiperidine-4-carboxylate.
Chemical Property Profile of Methyl 4-phenylpiperidine-4-carboxylate
Property Insights of Methyl 4-phenylpiperidine-4-carboxylate
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 4-phenylpiperidine-4-carboxylate. With a topological polar surface area (TPSA) of 38.3 Ų, Methyl 4-phenylpiperidine-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 4-phenylpiperidine-4-carboxylate 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 Methyl 4-phenylpiperidine-4-carboxylate?
The CAS number of Methyl 4-phenylpiperidine-4-carboxylate is 54824-07-6.
What is the molecular formula of Methyl 4-phenylpiperidine-4-carboxylate?
The molecular formula of Methyl 4-phenylpiperidine-4-carboxylate is C13H17NO2.
What is the molecular weight of Methyl 4-phenylpiperidine-4-carboxylate?
The molecular weight of Methyl 4-phenylpiperidine-4-carboxylate is 219.13 g/mol.
Where can I buy Methyl 4-phenylpiperidine-4-carboxylate?
You can request a quote for Methyl 4-phenylpiperidine-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-phenylpiperidine-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-phenylpiperidine-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.