![2-({N-[(4-methylphenyl)sulfonyl]-N-[4-(propan-2-yl)phenyl]glycyl}amino)benzoic acid structure](/static/products/4285/428501-81-9.webp)
2-({N-[(4-methylphenyl)sulfonyl]-N-[4-(propan-2-yl)phenyl]glycyl}amino)benzoic acid
TL;DR: 2-({N-[(4-methylphenyl)sulfonyl]-N-[4-(propan-2-yl)phenyl]glycyl}amino)benzoic acid (CAS 428501-81-9) is a chemical compound with molecular formula C25H26N2O5S and molecular weight 466.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-(N-(4-methylphenyl)sulfonyl-4-propan-2-ylanilino)acetyl]amino]benzoic acid
Also Known As: 2-({N-[(4-methylphenyl)sulfonyl]-N-[4-(propan-2-yl)phenyl]glycyl}amino)benzoic acid, 2-(2-(N-(4-isopropylphenyl)-4-methylphenylsulfonamido)acetamido)benzoic acid, 2-[[2-(N-(4-methylphenyl)sulfonyl-4-propan-2-ylanilino)acetyl]amino]benzoic acid, 2-[[2-[(4-methylphenyl)sulfonyl-(4-propan-2-ylphenyl)amino]acetyl]amino]benzoic Acid
| Molecular Formula | C25H26N2O5S |
|---|---|
| Molecular Weight | 466.16 g/mol |
| LogP | 4.65062 |
| Topological Polar Surface Area | 103.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 466.15625 |
| Heavy Atoms | 33 |
| Complexity | 1250.7146 |
Chemical Identifiers
| CAS Number | 428501-81-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=CC=CC=C2C(=O)O)C3=CC=C(C=C3)C(C)C |
Product Overview
2-({N-[(4-methylphenyl)sulfonyl]-N-[4-(propan-2-yl)phenyl]glycyl}amino)benzoic acid (CAS 428501-81-9), with molecular formula C25H26N2O5S and molecular weight 466.16 g/mol. IUPAC: 2-[[2-(N-(4-methylphenyl)sulfonyl-4-propan-2-ylanilino)acetyl]amino]benzoic acid.
Chemical Property Profile of 2-({N-[(4-methylphenyl)sulfonyl]-N-[4-(propan-2-yl)phenyl]glycyl}amino)benzoic acid
Property Insights of 2-({N-[(4-methylphenyl)sulfonyl]-N-[4-(propan-2-yl)phenyl]glycyl}amino)benzoic acid
The XLogP value of 4.65062 indicates that 2-({N-[(4-methylphenyl)sulfonyl]-N-[4-(propan-2-yl)phenyl]glycyl}amino)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-({N-[(4-methylphenyl)sulfonyl]-N-[4-(propan-2-yl)phenyl]glycyl}amino)benzoic acid. Following Lipinski's Rule of Five, 2-({N-[(4-methylphenyl)sulfonyl]-N-[4-(propan-2-yl)phenyl]glycyl}amino)benzoic acid has 2 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 2-({N-[(4-methylphenyl)sulfonyl]-N-[4-(propan-2-yl)phenyl]glycyl}amino)benzoic acid?
The CAS number of 2-({N-[(4-methylphenyl)sulfonyl]-N-[4-(propan-2-yl)phenyl]glycyl}amino)benzoic acid is 428501-81-9.
What is the molecular formula of 2-({N-[(4-methylphenyl)sulfonyl]-N-[4-(propan-2-yl)phenyl]glycyl}amino)benzoic acid?
The molecular formula of 2-({N-[(4-methylphenyl)sulfonyl]-N-[4-(propan-2-yl)phenyl]glycyl}amino)benzoic acid is C25H26N2O5S.
What is the molecular weight of 2-({N-[(4-methylphenyl)sulfonyl]-N-[4-(propan-2-yl)phenyl]glycyl}amino)benzoic acid?
The molecular weight of 2-({N-[(4-methylphenyl)sulfonyl]-N-[4-(propan-2-yl)phenyl]glycyl}amino)benzoic acid is 466.16 g/mol.
Where can I buy 2-({N-[(4-methylphenyl)sulfonyl]-N-[4-(propan-2-yl)phenyl]glycyl}amino)benzoic acid?
You can request a quote for 2-({N-[(4-methylphenyl)sulfonyl]-N-[4-(propan-2-yl)phenyl]glycyl}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 2-({N-[(4-methylphenyl)sulfonyl]-N-[4-(propan-2-yl)phenyl]glycyl}amino)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-({N-[(4-methylphenyl)sulfonyl]-N-[4-(propan-2-yl)phenyl]glycyl}amino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.