![3-{[2-(4-Sulfamoylphenyl)ethyl]sulfamoyl}benzoic acid structure](/static/products/7945/794553-85-8.webp)
3-{[2-(4-Sulfamoylphenyl)ethyl]sulfamoyl}benzoic acid
TL;DR: 3-{[2-(4-Sulfamoylphenyl)ethyl]sulfamoyl}benzoic acid (CAS 794553-85-8) is a chemical compound with molecular formula C15H16N2O6S2 and molecular weight 384.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(4-sulfamoylphenyl)ethylsulfamoyl]benzoic acid
Also Known As: 3-{[2-(4-sulfamoylphenyl)ethyl]sulfamoyl}benzoic acid, 3-[2-(4-sulfamoylphenyl)ethylsulfamoyl]benzoic Acid, 3-[({2-[4-(aminosulfonyl)phenyl]ethyl}amino)sulfonyl]benzoic acid, 3-{[2-(4-sulfamoylphenyl)ethyl]sulfamoyl}benzoicacid, 3-[((2-[4-(Aminosulfonyl)phenyl]ethyl)amino)sulfonyl]benzoic acid
| Molecular Formula | C15H16N2O6S2 |
|---|---|
| Molecular Weight | 384.04 g/mol |
| LogP | 0.5532 |
| Topological Polar Surface Area | 143.63 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 384.04498 |
| Heavy Atoms | 25 |
| Complexity | 982.9366 |
Chemical Identifiers
| CAS Number | 794553-85-8 |
|---|---|
| SMILES | C1=CC(=CC(=C1)S(=O)(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N)C(=O)O |
Product Overview
3-{[2-(4-Sulfamoylphenyl)ethyl]sulfamoyl}benzoic acid (CAS 794553-85-8), with molecular formula C15H16N2O6S2 and molecular weight 384.04 g/mol. IUPAC: 3-[2-(4-sulfamoylphenyl)ethylsulfamoyl]benzoic acid.
Chemical Property Profile of 3-{[2-(4-Sulfamoylphenyl)ethyl]sulfamoyl}benzoic acid
Property Insights of 3-{[2-(4-Sulfamoylphenyl)ethyl]sulfamoyl}benzoic acid
The XLogP value of 0.5532 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-{[2-(4-Sulfamoylphenyl)ethyl]sulfamoyl}benzoic acid. The TPSA of 143.63 Ų indicates high polarity, suggesting 3-{[2-(4-Sulfamoylphenyl)ethyl]sulfamoyl}benzoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3-{[2-(4-Sulfamoylphenyl)ethyl]sulfamoyl}benzoic acid has 3 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 3-{[2-(4-Sulfamoylphenyl)ethyl]sulfamoyl}benzoic acid?
The CAS number of 3-{[2-(4-Sulfamoylphenyl)ethyl]sulfamoyl}benzoic acid is 794553-85-8.
What is the molecular formula of 3-{[2-(4-Sulfamoylphenyl)ethyl]sulfamoyl}benzoic acid?
The molecular formula of 3-{[2-(4-Sulfamoylphenyl)ethyl]sulfamoyl}benzoic acid is C15H16N2O6S2.
What is the molecular weight of 3-{[2-(4-Sulfamoylphenyl)ethyl]sulfamoyl}benzoic acid?
The molecular weight of 3-{[2-(4-Sulfamoylphenyl)ethyl]sulfamoyl}benzoic acid is 384.04 g/mol.
Where can I buy 3-{[2-(4-Sulfamoylphenyl)ethyl]sulfamoyl}benzoic acid?
You can request a quote for 3-{[2-(4-Sulfamoylphenyl)ethyl]sulfamoyl}benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{[2-(4-Sulfamoylphenyl)ethyl]sulfamoyl}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-{[2-(4-Sulfamoylphenyl)ethyl]sulfamoyl}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.