4-(N,4-dimethylphenylsulfonamido)benzoic acid
TL;DR: 4-(N,4-dimethylphenylsulfonamido)benzoic acid (CAS 16962-40-6) is a chemical compound with molecular formula C15H15NO4S and molecular weight 305.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[methyl-(4-methylphenyl)sulfonylamino]benzoic acid
Also Known As: 4-{methyl[(4-methylphenyl)sulfonyl]amino}benzoic acid, 4-(N,4-Dimethylphenylsulfonamido)benzoic acid, 4-[methyl-(4-methylphenyl)sulfonylamino]benzoic acid, 4-[Methyl[(4-methylphenyl)sulfonyl]amino]benzoic acid, Benzoic acid, 4-[methyl[(4-methylphenyl)sulfonyl]amino]-
| Molecular Formula | C15H15NO4S |
|---|---|
| Molecular Weight | 305.07 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 305.07217 |
| Heavy Atoms | 21 |
| Complexity | 455.0 |
Chemical Identifiers
| CAS Number | 16962-40-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)O |
| InChIKey | WPQPCXKPUOSINE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(N,4-dimethylphenylsulfonamido)benzoic acid (CAS 16962-40-6), with molecular formula C15H15NO4S and molecular weight 305.07 g/mol. IUPAC: 4-[methyl-(4-methylphenyl)sulfonylamino]benzoic acid.
Chemical Property Profile of 4-(N,4-dimethylphenylsulfonamido)benzoic acid
Property Insights of 4-(N,4-dimethylphenylsulfonamido)benzoic acid
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(N,4-dimethylphenylsulfonamido)benzoic acid. The TPSA of 83.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(N,4-dimethylphenylsulfonamido)benzoic acid. Following Lipinski's Rule of Five, 4-(N,4-dimethylphenylsulfonamido)benzoic acid has 1 hydrogen bond donor(s) and 5 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-(N,4-dimethylphenylsulfonamido)benzoic acid?
The CAS number of 4-(N,4-dimethylphenylsulfonamido)benzoic acid is 16962-40-6.
What is the molecular formula of 4-(N,4-dimethylphenylsulfonamido)benzoic acid?
The molecular formula of 4-(N,4-dimethylphenylsulfonamido)benzoic acid is C15H15NO4S.
What is the molecular weight of 4-(N,4-dimethylphenylsulfonamido)benzoic acid?
The molecular weight of 4-(N,4-dimethylphenylsulfonamido)benzoic acid is 305.07 g/mol.
Where can I buy 4-(N,4-dimethylphenylsulfonamido)benzoic acid?
You can request a quote for 4-(N,4-dimethylphenylsulfonamido)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(N,4-dimethylphenylsulfonamido)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(N,4-dimethylphenylsulfonamido)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.