![5-[[(E)-2-phenylethenyl]sulfonylamino]benzene-1,3-dicarboxylic acid structure](/static/products/3156/315677-95-3.webp)
5-[[(E)-2-phenylethenyl]sulfonylamino]benzene-1,3-dicarboxylic acid
TL;DR: 5-[[(E)-2-phenylethenyl]sulfonylamino]benzene-1,3-dicarboxylic acid (CAS 315677-95-3) is a chemical compound with molecular formula C16H13NO6S and molecular weight 347.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[[(E)-2-phenylethenyl]sulfonylamino]benzene-1,3-dicarboxylic acid
Also Known As: 5-(2-phenylethenesulfonamido)benzene-1,3-dicarboxylic acid, 5-[[(E)-2-phenylethenyl]sulfonylamino]benzene-1,3-dicarboxylic acid, AF-399/15599163, 5-{[(2-phenylvinyl)sulfonyl]amino}isophthalic acid, 5-(2-phenylethenylsulfonylamino)benzene-1,3-dicarboxylic Acid
| Molecular Formula | C16H13NO6S |
|---|---|
| Molecular Weight | 347.05 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 347.04636 |
| Heavy Atoms | 24 |
| Complexity | 566.0 |
Chemical Identifiers
| CAS Number | 315677-95-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/S(=O)(=O)NC2=CC(=CC(=C2)C(=O)O)C(=O)O |
| InChIKey | PIVKKOHQYLJNQI-VOTSOKGWSA-N |
Product Overview
5-[[(E)-2-phenylethenyl]sulfonylamino]benzene-1,3-dicarboxylic acid (CAS 315677-95-3), with molecular formula C16H13NO6S and molecular weight 347.05 g/mol. IUPAC: 5-[[(E)-2-phenylethenyl]sulfonylamino]benzene-1,3-dicarboxylic acid.
Chemical Property Profile of 5-[[(E)-2-phenylethenyl]sulfonylamino]benzene-1,3-dicarboxylic acid
Property Insights of 5-[[(E)-2-phenylethenyl]sulfonylamino]benzene-1,3-dicarboxylic acid
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-[[(E)-2-phenylethenyl]sulfonylamino]benzene-1,3-dicarboxylic acid. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-[[(E)-2-phenylethenyl]sulfonylamino]benzene-1,3-dicarboxylic acid. Following Lipinski's Rule of Five, 5-[[(E)-2-phenylethenyl]sulfonylamino]benzene-1,3-dicarboxylic acid has 3 hydrogen bond donor(s) and 7 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 5-[[(E)-2-phenylethenyl]sulfonylamino]benzene-1,3-dicarboxylic acid?
The CAS number of 5-[[(E)-2-phenylethenyl]sulfonylamino]benzene-1,3-dicarboxylic acid is 315677-95-3.
What is the molecular formula of 5-[[(E)-2-phenylethenyl]sulfonylamino]benzene-1,3-dicarboxylic acid?
The molecular formula of 5-[[(E)-2-phenylethenyl]sulfonylamino]benzene-1,3-dicarboxylic acid is C16H13NO6S.
What is the molecular weight of 5-[[(E)-2-phenylethenyl]sulfonylamino]benzene-1,3-dicarboxylic acid?
The molecular weight of 5-[[(E)-2-phenylethenyl]sulfonylamino]benzene-1,3-dicarboxylic acid is 347.05 g/mol.
Where can I buy 5-[[(E)-2-phenylethenyl]sulfonylamino]benzene-1,3-dicarboxylic acid?
You can request a quote for 5-[[(E)-2-phenylethenyl]sulfonylamino]benzene-1,3-dicarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-[[(E)-2-phenylethenyl]sulfonylamino]benzene-1,3-dicarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-[[(E)-2-phenylethenyl]sulfonylamino]benzene-1,3-dicarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.