![2-[4-(3-Chlorobenzenesulfonyl)piperazine-1-carbonyl]benzoic acid structure](/static/products/7434/743445-14-9.webp)
2-[4-(3-Chlorobenzenesulfonyl)piperazine-1-carbonyl]benzoic acid
TL;DR: 2-[4-(3-Chlorobenzenesulfonyl)piperazine-1-carbonyl]benzoic acid (CAS 743445-14-9) is a chemical compound with molecular formula C18H17ClN2O5S and molecular weight 408.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(3-chlorophenyl)sulfonylpiperazine-1-carbonyl]benzoic acid
Also Known As: 2-[4-(3-chlorobenzenesulfonyl)piperazine-1-carbonyl]benzoic acid, 2-[4-(3-chlorophenyl)sulfonylpiperazine-1-carbonyl]benzoic Acid, 2-({4-[(3-chlorophenyl)sulfonyl]piperazin-1-yl}carbonyl)benzoic acid, 2-((4-[(3-Chlorophenyl)sulfonyl]piperazin-1-yl)carbonyl)benzoic acid, 2-[4-(3-chlorobenzenesulfonyl)piperazine-1-carbonyl]benzoicacid
| Molecular Formula | C18H17ClN2O5S |
|---|---|
| Molecular Weight | 408.05 g/mol |
| LogP | 2.1849 |
| Topological Polar Surface Area | 94.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 408.05466 |
| Heavy Atoms | 27 |
| Complexity | 984.7514 |
Chemical Identifiers
| CAS Number | 743445-14-9 |
|---|---|
| SMILES | C1CN(CCN1C(=O)C2=CC=CC=C2C(=O)O)S(=O)(=O)C3=CC(=CC=C3)Cl |
Product Overview
2-[4-(3-Chlorobenzenesulfonyl)piperazine-1-carbonyl]benzoic acid (CAS 743445-14-9), with molecular formula C18H17ClN2O5S and molecular weight 408.05 g/mol. IUPAC: 2-[4-(3-chlorophenyl)sulfonylpiperazine-1-carbonyl]benzoic acid.
Chemical Property Profile of 2-[4-(3-Chlorobenzenesulfonyl)piperazine-1-carbonyl]benzoic acid
Property Insights of 2-[4-(3-Chlorobenzenesulfonyl)piperazine-1-carbonyl]benzoic acid
The XLogP value of 2.1849 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[4-(3-Chlorobenzenesulfonyl)piperazine-1-carbonyl]benzoic acid. The TPSA of 94.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[4-(3-Chlorobenzenesulfonyl)piperazine-1-carbonyl]benzoic acid. Following Lipinski's Rule of Five, 2-[4-(3-Chlorobenzenesulfonyl)piperazine-1-carbonyl]benzoic 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 2-[4-(3-Chlorobenzenesulfonyl)piperazine-1-carbonyl]benzoic acid?
The CAS number of 2-[4-(3-Chlorobenzenesulfonyl)piperazine-1-carbonyl]benzoic acid is 743445-14-9.
What is the molecular formula of 2-[4-(3-Chlorobenzenesulfonyl)piperazine-1-carbonyl]benzoic acid?
The molecular formula of 2-[4-(3-Chlorobenzenesulfonyl)piperazine-1-carbonyl]benzoic acid is C18H17ClN2O5S.
What is the molecular weight of 2-[4-(3-Chlorobenzenesulfonyl)piperazine-1-carbonyl]benzoic acid?
The molecular weight of 2-[4-(3-Chlorobenzenesulfonyl)piperazine-1-carbonyl]benzoic acid is 408.05 g/mol.
Where can I buy 2-[4-(3-Chlorobenzenesulfonyl)piperazine-1-carbonyl]benzoic acid?
You can request a quote for 2-[4-(3-Chlorobenzenesulfonyl)piperazine-1-carbonyl]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-(3-Chlorobenzenesulfonyl)piperazine-1-carbonyl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(3-Chlorobenzenesulfonyl)piperazine-1-carbonyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.