Methyl 4-[[2-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate
TL;DR: Methyl 4-[[2-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate (CAS 338430-65-2) 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.
methyl 4-[[2-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate
Also Known As: BAS 02251512, methyl 4-(2-(4-methylphenylsulfonamido)benzamido)benzoate, methyl 4-[(2-{[(4-methylphenyl)sulfonyl]amino}benzoyl)amino]benzoate, methyl 4-[[2-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate, 4-[2-(Toluene-4-sulfonylamino)-benzoylamino]-benzoic acid methyl ester
| Molecular Formula | C22H20N2O5S |
|---|---|
| Molecular Weight | 424.11 g/mol |
| LogP | 3.83472 |
| Topological Polar Surface Area | 101.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 424.10928 |
| Heavy Atoms | 30 |
| Complexity | 1170.9095 |
Chemical Identifiers
| CAS Number | 338430-65-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)NC3=CC=C(C=C3)C(=O)OC |
Product Overview
Methyl 4-[[2-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate (CAS 338430-65-2), with molecular formula C22H20N2O5S and molecular weight 424.11 g/mol. IUPAC: methyl 4-[[2-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate.
Chemical Property Profile of Methyl 4-[[2-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate
Property Insights of Methyl 4-[[2-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate
The XLogP value of 3.83472 indicates that Methyl 4-[[2-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.57 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-[[2-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate. Following Lipinski's Rule of Five, Methyl 4-[[2-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate has 2 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 Methyl 4-[[2-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate?
The CAS number of Methyl 4-[[2-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate is 338430-65-2.
What is the molecular formula of Methyl 4-[[2-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate?
The molecular formula of Methyl 4-[[2-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate is C22H20N2O5S.
What is the molecular weight of Methyl 4-[[2-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate?
The molecular weight of Methyl 4-[[2-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate is 424.11 g/mol.
Where can I buy Methyl 4-[[2-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate?
You can request a quote for Methyl 4-[[2-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-[[2-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-[[2-[(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.