![2-{4-[Benzyl(methanesulfonyl)amino]benzamido}benzoic acid structure](/static/products/6461/6461-48-9.webp)
2-{4-[Benzyl(methanesulfonyl)amino]benzamido}benzoic acid
TL;DR: 2-{4-[Benzyl(methanesulfonyl)amino]benzamido}benzoic acid (CAS 6461-48-9) is a chemical compound with molecular formula C22H20N2O5S and molecular weight 424.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-[benzyl(methylsulfonyl)amino]benzoyl]amino]benzoic acid
Also Known As: 2-{4-[Benzyl(methanesulfonyl)amino]benzamido}benzoic acid, 2-({4-[benzyl(methylsulfonyl)amino]benzoyl}amino)benzoic acid, 2-[[4-[benzyl(methylsulfonyl)amino]benzoyl]amino]benzoic acid, 2-[[4-(benzyl-methylsulfonyl-amino)benzoyl]amino]benzoic Acid, 2-[4-(N-BENZYLMETHANESULFONAMIDO)BENZAMIDO]BENZOIC ACID
| Molecular Formula | C22H20N2O5S |
|---|---|
| Molecular Weight | 424.11 g/mol |
| LogP | 3.6033 |
| Topological Polar Surface Area | 103.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 424.10928 |
| Heavy Atoms | 30 |
| Complexity | 1159.647 |
Chemical Identifiers
| CAS Number | 6461-48-9 |
|---|---|
| SMILES | CS(=O)(=O)N(CC1=CC=CC=C1)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)O |
Product Overview
2-{4-[Benzyl(methanesulfonyl)amino]benzamido}benzoic acid (CAS 6461-48-9), with molecular formula C22H20N2O5S and molecular weight 424.11 g/mol. IUPAC: 2-[[4-[benzyl(methylsulfonyl)amino]benzoyl]amino]benzoic acid.
Chemical Property Profile of 2-{4-[Benzyl(methanesulfonyl)amino]benzamido}benzoic acid
Property Insights of 2-{4-[Benzyl(methanesulfonyl)amino]benzamido}benzoic acid
The XLogP value of 3.6033 indicates that 2-{4-[Benzyl(methanesulfonyl)amino]benzamido}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-{4-[Benzyl(methanesulfonyl)amino]benzamido}benzoic acid. Following Lipinski's Rule of Five, 2-{4-[Benzyl(methanesulfonyl)amino]benzamido}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-{4-[Benzyl(methanesulfonyl)amino]benzamido}benzoic acid?
The CAS number of 2-{4-[Benzyl(methanesulfonyl)amino]benzamido}benzoic acid is 6461-48-9.
What is the molecular formula of 2-{4-[Benzyl(methanesulfonyl)amino]benzamido}benzoic acid?
The molecular formula of 2-{4-[Benzyl(methanesulfonyl)amino]benzamido}benzoic acid is C22H20N2O5S.
What is the molecular weight of 2-{4-[Benzyl(methanesulfonyl)amino]benzamido}benzoic acid?
The molecular weight of 2-{4-[Benzyl(methanesulfonyl)amino]benzamido}benzoic acid is 424.11 g/mol.
Where can I buy 2-{4-[Benzyl(methanesulfonyl)amino]benzamido}benzoic acid?
You can request a quote for 2-{4-[Benzyl(methanesulfonyl)amino]benzamido}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-{4-[Benzyl(methanesulfonyl)amino]benzamido}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-{4-[Benzyl(methanesulfonyl)amino]benzamido}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.