4-(((4-Chlorophenyl)sulfonyl)amino)benzoic acid
TL;DR: 4-(((4-Chlorophenyl)sulfonyl)amino)benzoic acid (CAS 63421-70-5) is a chemical compound with molecular formula C13H10ClNO4S and molecular weight 311.0019 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(4-chlorophenyl)sulfonylamino]benzoic acid
Also Known As: 4-{[(4-chlorophenyl)sulfonyl]amino}benzoic acid, 4-[(4-chlorophenyl)sulfonylamino]benzoic acid, UPCMLD0ENAT5417426:001, Benzoic acid, 4-[[(4-chlorophenyl)sulfonyl]amino]-, BAS 00116535
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H10ClNO4S |
| Molecular Weight | 311.0019 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 91.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 311.0019 Da |
| Heavy Atoms | 20 |
| Complexity | 432.0 |
| SMILES | C1=CC(=CC=C1C(=O)O)NS(=O)(=O)C2=CC=C(C=C2)Cl |
| InChIKey | IBRLPMYEEPGIAK-UHFFFAOYSA-N |
Chemical Property Profile of 4-(((4-Chlorophenyl)sulfonyl)amino)benzoic acid
Property Insights of 4-(((4-Chlorophenyl)sulfonyl)amino)benzoic acid
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(((4-Chlorophenyl)sulfonyl)amino)benzoic acid. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(((4-Chlorophenyl)sulfonyl)amino)benzoic acid. Following Lipinski's Rule of Five, 4-(((4-Chlorophenyl)sulfonyl)amino)benzoic acid has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(((4-Chlorophenyl)sulfonyl)amino)benzoic acid?
The CAS number of 4-(((4-Chlorophenyl)sulfonyl)amino)benzoic acid is 63421-70-5.
What is the molecular formula of 4-(((4-Chlorophenyl)sulfonyl)amino)benzoic acid?
The molecular formula of 4-(((4-Chlorophenyl)sulfonyl)amino)benzoic acid is C13H10ClNO4S.
What is the molecular weight of 4-(((4-Chlorophenyl)sulfonyl)amino)benzoic acid?
The molecular weight of 4-(((4-Chlorophenyl)sulfonyl)amino)benzoic acid is 311.0019 g/mol.
Where can I buy 4-(((4-Chlorophenyl)sulfonyl)amino)benzoic acid?
You can request a quote for 4-(((4-Chlorophenyl)sulfonyl)amino)benzoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(((4-Chlorophenyl)sulfonyl)amino)benzoic acid?
Yes, CoreyChem provides custom synthesis services for 4-(((4-Chlorophenyl)sulfonyl)amino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.