4-(2-Methanesulfonamidoethyl)benzoic acid
TL;DR: 4-(2-Methanesulfonamidoethyl)benzoic acid (CAS 79094-22-7) is a chemical compound with molecular formula C10H13NO4S and molecular weight 243.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(methanesulfonamido)ethyl]benzoic acid
Also Known As: 4-(2-methanesulfonamidoethyl)benzoic Acid, 4-[2-(methanesulfonamido)ethyl]benzoic acid, 4-(2-[(Methylsulfonyl)amino]ethyl)benzoic acid, 4-{2-[(methylsulfonyl)amino]ethyl}benzoic acid, 4-(2-methanesulfonamidoethyl)benzoicAcid
| Molecular Formula | C10H13NO4S |
|---|---|
| Molecular Weight | 243.06 g/mol |
| LogP | 0.4765 |
| Topological Polar Surface Area | 83.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 243.05653 |
| Heavy Atoms | 16 |
| Complexity | 464.09732 |
Chemical Identifiers
| CAS Number | 79094-22-7 |
|---|---|
| SMILES | CS(=O)(=O)NCCC1=CC=C(C=C1)C(=O)O |
Product Overview
4-(2-Methanesulfonamidoethyl)benzoic acid (CAS 79094-22-7), with molecular formula C10H13NO4S and molecular weight 243.06 g/mol. IUPAC: 4-[2-(methanesulfonamido)ethyl]benzoic acid.
Chemical Property Profile of 4-(2-Methanesulfonamidoethyl)benzoic acid
Property Insights of 4-(2-Methanesulfonamidoethyl)benzoic acid
The XLogP value of 0.4765 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Methanesulfonamidoethyl)benzoic acid. The TPSA of 83.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Methanesulfonamidoethyl)benzoic acid. Following Lipinski's Rule of Five, 4-(2-Methanesulfonamidoethyl)benzoic acid has 2 hydrogen bond donor(s) and 3 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-(2-Methanesulfonamidoethyl)benzoic acid?
The CAS number of 4-(2-Methanesulfonamidoethyl)benzoic acid is 79094-22-7.
What is the molecular formula of 4-(2-Methanesulfonamidoethyl)benzoic acid?
The molecular formula of 4-(2-Methanesulfonamidoethyl)benzoic acid is C10H13NO4S.
What is the molecular weight of 4-(2-Methanesulfonamidoethyl)benzoic acid?
The molecular weight of 4-(2-Methanesulfonamidoethyl)benzoic acid is 243.06 g/mol.
Where can I buy 4-(2-Methanesulfonamidoethyl)benzoic acid?
You can request a quote for 4-(2-Methanesulfonamidoethyl)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-(2-Methanesulfonamidoethyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Methanesulfonamidoethyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.