4-Piperidinecarboxylic acid, 4-phenyl-, 4-methylbenzenesulfonate (1:1)
TL;DR: 4-Piperidinecarboxylic acid, 4-phenyl-, 4-methylbenzenesulfonate (1:1) (CAS 83949-32-0) is a chemical compound with molecular formula C19H23NO5S and molecular weight 377.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methylbenzenesulfonic acid;4-phenylpiperidine-4-carboxylic acid
Also Known As: 4-methylbenzene-1-sulfonic acid; 4-phenylpiperidine-4-carboxylic acid, EINECS 281-391-7, 0352AF, 4-Carboxy-4-phenylpiperidine tosylate, 4-Phenyl-4-carboxy piperidine tosylate
| Molecular Formula | C19H23NO5S |
|---|---|
| Molecular Weight | 377.13 g/mol |
| LogP | 2.63412 |
| Topological Polar Surface Area | 103.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 377.1297 |
| Heavy Atoms | 26 |
| Complexity | 825.99304 |
Chemical Identifiers
| CAS Number | 83949-32-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)O.C1CNCCC1(C2=CC=CC=C2)C(=O)O |
Product Overview
4-Piperidinecarboxylic acid, 4-phenyl-, 4-methylbenzenesulfonate (1:1) (CAS 83949-32-0), with molecular formula C19H23NO5S and molecular weight 377.13 g/mol. IUPAC: 4-methylbenzenesulfonic acid;4-phenylpiperidine-4-carboxylic acid.
Chemical Property Profile of 4-Piperidinecarboxylic acid, 4-phenyl-, 4-methylbenzenesulfonate (1:1)
Property Insights of 4-Piperidinecarboxylic acid, 4-phenyl-, 4-methylbenzenesulfonate (1:1)
The XLogP value of 2.63412 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Piperidinecarboxylic acid, 4-phenyl-, 4-methylbenzenesulfonate (1:1). The TPSA of 103.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Piperidinecarboxylic acid, 4-phenyl-, 4-methylbenzenesulfonate (1:1). Following Lipinski's Rule of Five, 4-Piperidinecarboxylic acid, 4-phenyl-, 4-methylbenzenesulfonate (1:1) has 3 hydrogen bond donor(s) and 4 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-Piperidinecarboxylic acid, 4-phenyl-, 4-methylbenzenesulfonate (1:1)?
The CAS number of 4-Piperidinecarboxylic acid, 4-phenyl-, 4-methylbenzenesulfonate (1:1) is 83949-32-0.
What is the molecular formula of 4-Piperidinecarboxylic acid, 4-phenyl-, 4-methylbenzenesulfonate (1:1)?
The molecular formula of 4-Piperidinecarboxylic acid, 4-phenyl-, 4-methylbenzenesulfonate (1:1) is C19H23NO5S.
What is the molecular weight of 4-Piperidinecarboxylic acid, 4-phenyl-, 4-methylbenzenesulfonate (1:1)?
The molecular weight of 4-Piperidinecarboxylic acid, 4-phenyl-, 4-methylbenzenesulfonate (1:1) is 377.13 g/mol.
Where can I buy 4-Piperidinecarboxylic acid, 4-phenyl-, 4-methylbenzenesulfonate (1:1)?
You can request a quote for 4-Piperidinecarboxylic acid, 4-phenyl-, 4-methylbenzenesulfonate (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Piperidinecarboxylic acid, 4-phenyl-, 4-methylbenzenesulfonate (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 4-Piperidinecarboxylic acid, 4-phenyl-, 4-methylbenzenesulfonate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.