![3-[({5-[(E)-2-carboxyethenyl]-2-methoxyphenyl}sulfonyl)amino]benzoic acid structure](/static/products/5553/5553-61-7.webp)
3-[({5-[(E)-2-carboxyethenyl]-2-methoxyphenyl}sulfonyl)amino]benzoic acid
TL;DR: 3-[({5-[(E)-2-carboxyethenyl]-2-methoxyphenyl}sulfonyl)amino]benzoic acid (CAS 5553-61-7) is a chemical compound with molecular formula C17H15NO7S and molecular weight 377.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[5-[(E)-2-carboxyethenyl]-2-methoxyphenyl]sulfonylamino]benzoic acid
Also Known As: BIM-0024254.P001, (E)-3-(5-(2-carboxyvinyl)-2-methoxyphenylsulfonamido)benzoic acid, 3-({[5-((1E)-2-carboxyvinyl)-2-methoxyphenyl]sulfonyl}amino)benzoic acid, 3-[({5-[(E)-2-carboxyethenyl]-2-methoxyphenyl}sulfonyl)amino]benzoic acid, 3-[[5-[(E)-2-carboxyethenyl]-2-methoxyphenyl]sulfonylamino]benzoic acid
| Molecular Formula | C17H15NO7S |
|---|---|
| Molecular Weight | 377.06 g/mol |
| LogP | 2.292 |
| Topological Polar Surface Area | 130.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 377.05692 |
| Heavy Atoms | 26 |
| Complexity | 980.35596 |
Chemical Identifiers
| CAS Number | 5553-61-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C=C/C(=O)O)S(=O)(=O)NC2=CC=CC(=C2)C(=O)O |
Product Overview
3-[({5-[(E)-2-carboxyethenyl]-2-methoxyphenyl}sulfonyl)amino]benzoic acid (CAS 5553-61-7), with molecular formula C17H15NO7S and molecular weight 377.06 g/mol. IUPAC: 3-[[5-[(E)-2-carboxyethenyl]-2-methoxyphenyl]sulfonylamino]benzoic acid.
Chemical Property Profile of 3-[({5-[(E)-2-carboxyethenyl]-2-methoxyphenyl}sulfonyl)amino]benzoic acid
Property Insights of 3-[({5-[(E)-2-carboxyethenyl]-2-methoxyphenyl}sulfonyl)amino]benzoic acid
The XLogP value of 2.292 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[({5-[(E)-2-carboxyethenyl]-2-methoxyphenyl}sulfonyl)amino]benzoic acid. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[({5-[(E)-2-carboxyethenyl]-2-methoxyphenyl}sulfonyl)amino]benzoic acid. Following Lipinski's Rule of Five, 3-[({5-[(E)-2-carboxyethenyl]-2-methoxyphenyl}sulfonyl)amino]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-[({5-[(E)-2-carboxyethenyl]-2-methoxyphenyl}sulfonyl)amino]benzoic acid?
The CAS number of 3-[({5-[(E)-2-carboxyethenyl]-2-methoxyphenyl}sulfonyl)amino]benzoic acid is 5553-61-7.
What is the molecular formula of 3-[({5-[(E)-2-carboxyethenyl]-2-methoxyphenyl}sulfonyl)amino]benzoic acid?
The molecular formula of 3-[({5-[(E)-2-carboxyethenyl]-2-methoxyphenyl}sulfonyl)amino]benzoic acid is C17H15NO7S.
What is the molecular weight of 3-[({5-[(E)-2-carboxyethenyl]-2-methoxyphenyl}sulfonyl)amino]benzoic acid?
The molecular weight of 3-[({5-[(E)-2-carboxyethenyl]-2-methoxyphenyl}sulfonyl)amino]benzoic acid is 377.06 g/mol.
Where can I buy 3-[({5-[(E)-2-carboxyethenyl]-2-methoxyphenyl}sulfonyl)amino]benzoic acid?
You can request a quote for 3-[({5-[(E)-2-carboxyethenyl]-2-methoxyphenyl}sulfonyl)amino]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-[({5-[(E)-2-carboxyethenyl]-2-methoxyphenyl}sulfonyl)amino]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[({5-[(E)-2-carboxyethenyl]-2-methoxyphenyl}sulfonyl)amino]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.