4-[(Ethylamino)sulfonyl]benzoic acid
TL;DR: 4-[(Ethylamino)sulfonyl]benzoic acid (CAS 10252-64-9) is a chemical compound with molecular formula C9H11NO4S and molecular weight 229.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(ethylsulfamoyl)benzoic acid
Also Known As: 4-[(Ethylamino)sulfonyl]benzoic acid, 4-(ethylsulfamoyl)benzoic acid, 4-(N-Ethylsulfamoyl)benzoic acid, p-(Ethylsulfamoyl)benzoic acid, 4-Ethylsulfamoyl-benzoic acid
| Molecular Formula | C9H11NO4S |
|---|---|
| Molecular Weight | 229.04 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 91.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 229.04088 |
| Heavy Atoms | 15 |
| Complexity | 311.0 |
Chemical Identifiers
| CAS Number | 10252-64-9 |
|---|---|
| SMILES | CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)O |
| InChIKey | SKSHUBLFLCCPLP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-[(Ethylamino)sulfonyl]benzoic acid (CAS 10252-64-9), with molecular formula C9H11NO4S and molecular weight 229.04 g/mol. IUPAC: 4-(ethylsulfamoyl)benzoic acid.
Chemical Property Profile of 4-[(Ethylamino)sulfonyl]benzoic acid
Property Insights of 4-[(Ethylamino)sulfonyl]benzoic acid
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(Ethylamino)sulfonyl]benzoic acid. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[(Ethylamino)sulfonyl]benzoic acid. Following Lipinski's Rule of Five, 4-[(Ethylamino)sulfonyl]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
Frequently Asked Questions
What is the CAS number of 4-[(Ethylamino)sulfonyl]benzoic acid?
The CAS number of 4-[(Ethylamino)sulfonyl]benzoic acid is 10252-64-9.
What is the molecular formula of 4-[(Ethylamino)sulfonyl]benzoic acid?
The molecular formula of 4-[(Ethylamino)sulfonyl]benzoic acid is C9H11NO4S.
What is the molecular weight of 4-[(Ethylamino)sulfonyl]benzoic acid?
The molecular weight of 4-[(Ethylamino)sulfonyl]benzoic acid is 229.04 g/mol.
Where can I buy 4-[(Ethylamino)sulfonyl]benzoic acid?
You can request a quote for 4-[(Ethylamino)sulfonyl]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-[(Ethylamino)sulfonyl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[(Ethylamino)sulfonyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.