1-((2-Cyanophenyl)sulfonyl)-4-piperidinecarboxylic acid
TL;DR: 1-((2-Cyanophenyl)sulfonyl)-4-piperidinecarboxylic acid (CAS 871478-83-0) is a chemical compound with molecular formula C13H14N2O4S and molecular weight 294.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-cyanophenyl)sulfonylpiperidine-4-carboxylic acid
Also Known As: 1-(2-cyanobenzenesulfonyl)piperidine-4-carboxylic acid, 1-[(2-cyanophenyl)sulfonyl]piperidine-4-carboxylic acid, 1-(2-cyanophenyl)sulfonylpiperidine-4-carboxylic Acid, 1-[(2-Cyanophenyl)sulfonyl]-4-piperidinecarboxylic acid, 1-(2-cyanobenzenesulfonyl)piperidine-4-carboxylicacid
| Molecular Formula | C13H14N2O4S |
|---|---|
| Molecular Weight | 294.07 g/mol |
| LogP | 1.04358 |
| Topological Polar Surface Area | 98.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 294.0674 |
| Heavy Atoms | 20 |
| Complexity | 655.1939 |
Chemical Identifiers
| CAS Number | 871478-83-0 |
|---|---|
| SMILES | C1CN(CCC1C(=O)O)S(=O)(=O)C2=CC=CC=C2C#N |
Product Overview
1-((2-Cyanophenyl)sulfonyl)-4-piperidinecarboxylic acid (CAS 871478-83-0), with molecular formula C13H14N2O4S and molecular weight 294.07 g/mol. IUPAC: 1-(2-cyanophenyl)sulfonylpiperidine-4-carboxylic acid.
Chemical Property Profile of 1-((2-Cyanophenyl)sulfonyl)-4-piperidinecarboxylic acid
Property Insights of 1-((2-Cyanophenyl)sulfonyl)-4-piperidinecarboxylic acid
The XLogP value of 1.04358 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-((2-Cyanophenyl)sulfonyl)-4-piperidinecarboxylic acid. The TPSA of 98.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-((2-Cyanophenyl)sulfonyl)-4-piperidinecarboxylic acid. Following Lipinski's Rule of Five, 1-((2-Cyanophenyl)sulfonyl)-4-piperidinecarboxylic acid has 1 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 1-((2-Cyanophenyl)sulfonyl)-4-piperidinecarboxylic acid?
The CAS number of 1-((2-Cyanophenyl)sulfonyl)-4-piperidinecarboxylic acid is 871478-83-0.
What is the molecular formula of 1-((2-Cyanophenyl)sulfonyl)-4-piperidinecarboxylic acid?
The molecular formula of 1-((2-Cyanophenyl)sulfonyl)-4-piperidinecarboxylic acid is C13H14N2O4S.
What is the molecular weight of 1-((2-Cyanophenyl)sulfonyl)-4-piperidinecarboxylic acid?
The molecular weight of 1-((2-Cyanophenyl)sulfonyl)-4-piperidinecarboxylic acid is 294.07 g/mol.
Where can I buy 1-((2-Cyanophenyl)sulfonyl)-4-piperidinecarboxylic acid?
You can request a quote for 1-((2-Cyanophenyl)sulfonyl)-4-piperidinecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-((2-Cyanophenyl)sulfonyl)-4-piperidinecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-((2-Cyanophenyl)sulfonyl)-4-piperidinecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.