![4-{4-[(Mesitylamino)sulfonyl]anilino}-4-oxobutanoic acid structure](/static/products/4579/457922-04-2.webp)
4-{4-[(Mesitylamino)sulfonyl]anilino}-4-oxobutanoic acid
TL;DR: 4-{4-[(Mesitylamino)sulfonyl]anilino}-4-oxobutanoic acid (CAS 457922-04-2) is a chemical compound with molecular formula C19H22N2O5S and molecular weight 390.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxo-4-[4-[(2,4,6-trimethylphenyl)sulfamoyl]anilino]butanoic acid
Also Known As: 4-{4-[(mesitylamino)sulfonyl]anilino}-4-oxobutanoic acid, 4-((4-(N-mesitylsulfamoyl)phenyl)amino)-4-oxobutanoic acid, AN-329/40869089, 4-({4-[(mesitylamino)sulfonyl]phenyl}amino)-4-oxobutanoic acid, 4-oxo-4-[4-[(2,4,6-trimethylphenyl)sulfamoyl]anilino]butanoic acid
| Molecular Formula | C19H22N2O5S |
|---|---|
| Molecular Weight | 390.12 g/mol |
| LogP | 3.21596 |
| Topological Polar Surface Area | 112.57 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 390.12494 |
| Heavy Atoms | 27 |
| Complexity | 943.08966 |
Chemical Identifiers
| CAS Number | 457922-04-2 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC(=O)O)C |
Product Overview
4-{4-[(Mesitylamino)sulfonyl]anilino}-4-oxobutanoic acid (CAS 457922-04-2), with molecular formula C19H22N2O5S and molecular weight 390.12 g/mol. IUPAC: 4-oxo-4-[4-[(2,4,6-trimethylphenyl)sulfamoyl]anilino]butanoic acid.
Chemical Property Profile of 4-{4-[(Mesitylamino)sulfonyl]anilino}-4-oxobutanoic acid
Property Insights of 4-{4-[(Mesitylamino)sulfonyl]anilino}-4-oxobutanoic acid
The XLogP value of 3.21596 indicates that 4-{4-[(Mesitylamino)sulfonyl]anilino}-4-oxobutanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.57 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{4-[(Mesitylamino)sulfonyl]anilino}-4-oxobutanoic acid. Following Lipinski's Rule of Five, 4-{4-[(Mesitylamino)sulfonyl]anilino}-4-oxobutanoic acid has 3 hydrogen bond donor(s) and 4 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-{4-[(Mesitylamino)sulfonyl]anilino}-4-oxobutanoic acid?
The CAS number of 4-{4-[(Mesitylamino)sulfonyl]anilino}-4-oxobutanoic acid is 457922-04-2.
What is the molecular formula of 4-{4-[(Mesitylamino)sulfonyl]anilino}-4-oxobutanoic acid?
The molecular formula of 4-{4-[(Mesitylamino)sulfonyl]anilino}-4-oxobutanoic acid is C19H22N2O5S.
What is the molecular weight of 4-{4-[(Mesitylamino)sulfonyl]anilino}-4-oxobutanoic acid?
The molecular weight of 4-{4-[(Mesitylamino)sulfonyl]anilino}-4-oxobutanoic acid is 390.12 g/mol.
Where can I buy 4-{4-[(Mesitylamino)sulfonyl]anilino}-4-oxobutanoic acid?
You can request a quote for 4-{4-[(Mesitylamino)sulfonyl]anilino}-4-oxobutanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{4-[(Mesitylamino)sulfonyl]anilino}-4-oxobutanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-{4-[(Mesitylamino)sulfonyl]anilino}-4-oxobutanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.