1-(4-Chlorobenzyl)piperidine-4-carboxylic acid
TL;DR: 1-(4-Chlorobenzyl)piperidine-4-carboxylic acid (CAS 733798-69-1) is a chemical compound with molecular formula C13H16ClNO2 and molecular weight 253.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(4-chlorophenyl)methyl]piperidine-4-carboxylic acid
Also Known As: 1-(4-chlorobenzyl)piperidine-4-carboxylic acid, 1-(4-Chloro-benzyl)-piperidine-4-carboxylic acid, 1-[(4-chlorophenyl)methyl]piperidine-4-carboxylic acid, BAS 10145690, N-(4-Chlorobenzyl)piperidine-4-carboxylic acid
| Molecular Formula | C13H16ClNO2 |
|---|---|
| Molecular Weight | 253.09 g/mol |
| LogP | 2.6366 |
| Topological Polar Surface Area | 40.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 253.08696 |
| Heavy Atoms | 17 |
| Complexity | 382.91086 |
Chemical Identifiers
| CAS Number | 733798-69-1 |
|---|---|
| SMILES | C1CN(CCC1C(=O)O)CC2=CC=C(C=C2)Cl |
Product Overview
1-(4-Chlorobenzyl)piperidine-4-carboxylic acid (CAS 733798-69-1), with molecular formula C13H16ClNO2 and molecular weight 253.09 g/mol. IUPAC: 1-[(4-chlorophenyl)methyl]piperidine-4-carboxylic acid.
Chemical Property Profile of 1-(4-Chlorobenzyl)piperidine-4-carboxylic acid
Property Insights of 1-(4-Chlorobenzyl)piperidine-4-carboxylic acid
The XLogP value of 2.6366 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Chlorobenzyl)piperidine-4-carboxylic acid. With a topological polar surface area (TPSA) of 40.54 Ų, 1-(4-Chlorobenzyl)piperidine-4-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Chlorobenzyl)piperidine-4-carboxylic acid has 1 hydrogen bond donor(s) and 2 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-(4-Chlorobenzyl)piperidine-4-carboxylic acid?
The CAS number of 1-(4-Chlorobenzyl)piperidine-4-carboxylic acid is 733798-69-1.
What is the molecular formula of 1-(4-Chlorobenzyl)piperidine-4-carboxylic acid?
The molecular formula of 1-(4-Chlorobenzyl)piperidine-4-carboxylic acid is C13H16ClNO2.
What is the molecular weight of 1-(4-Chlorobenzyl)piperidine-4-carboxylic acid?
The molecular weight of 1-(4-Chlorobenzyl)piperidine-4-carboxylic acid is 253.09 g/mol.
Where can I buy 1-(4-Chlorobenzyl)piperidine-4-carboxylic acid?
You can request a quote for 1-(4-Chlorobenzyl)piperidine-4-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Chlorobenzyl)piperidine-4-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Chlorobenzyl)piperidine-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.