1-(4-Acetylbenzenesulfonyl)piperidine-2-carboxylic acid
TL;DR: 1-(4-Acetylbenzenesulfonyl)piperidine-2-carboxylic acid (CAS 809240-69-5) is a chemical compound with molecular formula C14H17NO5S and molecular weight 311.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-acetylphenyl)sulfonylpiperidine-2-carboxylic acid
Also Known As: 1-(4-acetylbenzenesulfonyl)piperidine-2-carboxylic acid, 1-[(4-acetylphenyl)sulfonyl]piperidine-2-carboxylic acid, 1-(4-acetylphenyl)sulfonylpiperidine-2-carboxylic Acid, 1-(4-acetylbenzenesulfonyl)piperidine-2-carboxylicacid, 1-(4-Acetylbenzene-1-sulfonyl)piperidine-2-carboxylic acid
| Molecular Formula | C14H17NO5S |
|---|---|
| Molecular Weight | 311.08 g/mol |
| LogP | 1.517 |
| Topological Polar Surface Area | 91.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 311.08273 |
| Heavy Atoms | 21 |
| Complexity | 650.4469 |
Chemical Identifiers
| CAS Number | 809240-69-5 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCCC2C(=O)O |
Product Overview
1-(4-Acetylbenzenesulfonyl)piperidine-2-carboxylic acid (CAS 809240-69-5), with molecular formula C14H17NO5S and molecular weight 311.08 g/mol. IUPAC: 1-(4-acetylphenyl)sulfonylpiperidine-2-carboxylic acid.
Chemical Property Profile of 1-(4-Acetylbenzenesulfonyl)piperidine-2-carboxylic acid
Property Insights of 1-(4-Acetylbenzenesulfonyl)piperidine-2-carboxylic acid
The XLogP value of 1.517 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Acetylbenzenesulfonyl)piperidine-2-carboxylic acid. The TPSA of 91.75 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Acetylbenzenesulfonyl)piperidine-2-carboxylic acid. Following Lipinski's Rule of Five, 1-(4-Acetylbenzenesulfonyl)piperidine-2-carboxylic 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-(4-Acetylbenzenesulfonyl)piperidine-2-carboxylic acid?
The CAS number of 1-(4-Acetylbenzenesulfonyl)piperidine-2-carboxylic acid is 809240-69-5.
What is the molecular formula of 1-(4-Acetylbenzenesulfonyl)piperidine-2-carboxylic acid?
The molecular formula of 1-(4-Acetylbenzenesulfonyl)piperidine-2-carboxylic acid is C14H17NO5S.
What is the molecular weight of 1-(4-Acetylbenzenesulfonyl)piperidine-2-carboxylic acid?
The molecular weight of 1-(4-Acetylbenzenesulfonyl)piperidine-2-carboxylic acid is 311.08 g/mol.
Where can I buy 1-(4-Acetylbenzenesulfonyl)piperidine-2-carboxylic acid?
You can request a quote for 1-(4-Acetylbenzenesulfonyl)piperidine-2-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-Acetylbenzenesulfonyl)piperidine-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Acetylbenzenesulfonyl)piperidine-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.