![Methyl 3-[[4-[(4-ethoxyphenyl)sulfonylamino]benzoyl]amino]benzoate structure](/static/products/5471/5471-41-0.webp)
Methyl 3-[[4-[(4-ethoxyphenyl)sulfonylamino]benzoyl]amino]benzoate
TL;DR: Methyl 3-[[4-[(4-ethoxyphenyl)sulfonylamino]benzoyl]amino]benzoate (CAS 5471-41-0) is a chemical compound with molecular formula C23H22N2O6S and molecular weight 454.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[[4-[(4-ethoxyphenyl)sulfonylamino]benzoyl]amino]benzoate
Also Known As: methyl 3-[[4-[(4-ethoxyphenyl)sulfonylamino]benzoyl]amino]benzoate
| Molecular Formula | C23H22N2O6S |
|---|---|
| Molecular Weight | 454.12 g/mol |
| LogP | 3.925 |
| Topological Polar Surface Area | 110.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 454.11984 |
| Heavy Atoms | 32 |
| Complexity | 1205.9939 |
Chemical Identifiers
| CAS Number | 5471-41-0 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C(=O)NC3=CC=CC(=C3)C(=O)OC |
Product Overview
Methyl 3-[[4-[(4-ethoxyphenyl)sulfonylamino]benzoyl]amino]benzoate (CAS 5471-41-0), with molecular formula C23H22N2O6S and molecular weight 454.12 g/mol. IUPAC: methyl 3-[[4-[(4-ethoxyphenyl)sulfonylamino]benzoyl]amino]benzoate.
Chemical Property Profile of Methyl 3-[[4-[(4-ethoxyphenyl)sulfonylamino]benzoyl]amino]benzoate
Property Insights of Methyl 3-[[4-[(4-ethoxyphenyl)sulfonylamino]benzoyl]amino]benzoate
The XLogP value of 3.925 indicates that Methyl 3-[[4-[(4-ethoxyphenyl)sulfonylamino]benzoyl]amino]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-[[4-[(4-ethoxyphenyl)sulfonylamino]benzoyl]amino]benzoate. Following Lipinski's Rule of Five, Methyl 3-[[4-[(4-ethoxyphenyl)sulfonylamino]benzoyl]amino]benzoate has 2 hydrogen bond donor(s) and 6 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 3-[[4-[(4-ethoxyphenyl)sulfonylamino]benzoyl]amino]benzoate?
The CAS number of Methyl 3-[[4-[(4-ethoxyphenyl)sulfonylamino]benzoyl]amino]benzoate is 5471-41-0.
What is the molecular formula of Methyl 3-[[4-[(4-ethoxyphenyl)sulfonylamino]benzoyl]amino]benzoate?
The molecular formula of Methyl 3-[[4-[(4-ethoxyphenyl)sulfonylamino]benzoyl]amino]benzoate is C23H22N2O6S.
What is the molecular weight of Methyl 3-[[4-[(4-ethoxyphenyl)sulfonylamino]benzoyl]amino]benzoate?
The molecular weight of Methyl 3-[[4-[(4-ethoxyphenyl)sulfonylamino]benzoyl]amino]benzoate is 454.12 g/mol.
Where can I buy Methyl 3-[[4-[(4-ethoxyphenyl)sulfonylamino]benzoyl]amino]benzoate?
You can request a quote for Methyl 3-[[4-[(4-ethoxyphenyl)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 3-[[4-[(4-ethoxyphenyl)sulfonylamino]benzoyl]amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-[[4-[(4-ethoxyphenyl)sulfonylamino]benzoyl]amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.