![Ethyl 4-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzoyl]amino]benzoate structure](/static/products/7186/718600-47-6.webp)
Ethyl 4-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzoyl]amino]benzoate
TL;DR: Ethyl 4-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzoyl]amino]benzoate (CAS 718600-47-6) is a chemical compound with molecular formula C25H26N2O7S and molecular weight 498.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzoyl]amino]benzoate
Also Known As: AN-698/42816941, ethyl 4-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzoyl]amino]benzoate, ethyl 4-({4-[[(3,4-dimethoxyphenyl)sulfonyl](methyl)amino]benzoyl}amino)benzoate, ethyl 4-(4-(3,4-dimethoxy-N-methylphenylsulfonamido)benzamido)benzoate, ethyl 4-{[(4-{[(3,4-dimethoxyphenyl)sulfonyl](methyl)amino}phenyl)carbonyl]amino}benzoate
| Molecular Formula | C25H26N2O7S |
|---|---|
| Molecular Weight | 498.15 g/mol |
| LogP | 3.9579 |
| Topological Polar Surface Area | 111.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 498.14606 |
| Heavy Atoms | 35 |
| Complexity | 1304.647 |
Chemical Identifiers
| CAS Number | 718600-47-6 |
|---|---|
| SMILES | CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC(=C(C=C3)OC)OC |
Product Overview
Ethyl 4-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzoyl]amino]benzoate (CAS 718600-47-6), with molecular formula C25H26N2O7S and molecular weight 498.15 g/mol. IUPAC: ethyl 4-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzoyl]amino]benzoate.
Chemical Property Profile of Ethyl 4-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzoyl]amino]benzoate
Property Insights of Ethyl 4-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzoyl]amino]benzoate
The XLogP value of 3.9579 indicates that Ethyl 4-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzoyl]amino]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.24 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 4-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzoyl]amino]benzoate. Following Lipinski's Rule of Five, Ethyl 4-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzoyl]amino]benzoate has 1 hydrogen bond donor(s) and 7 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 Ethyl 4-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzoyl]amino]benzoate?
The CAS number of Ethyl 4-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzoyl]amino]benzoate is 718600-47-6.
What is the molecular formula of Ethyl 4-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzoyl]amino]benzoate?
The molecular formula of Ethyl 4-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzoyl]amino]benzoate is C25H26N2O7S.
What is the molecular weight of Ethyl 4-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzoyl]amino]benzoate?
The molecular weight of Ethyl 4-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzoyl]amino]benzoate is 498.15 g/mol.
Where can I buy Ethyl 4-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzoyl]amino]benzoate?
You can request a quote for Ethyl 4-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]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 Ethyl 4-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzoyl]amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 4-[[4-[(3,4-dimethoxyphenyl)sulfonyl-methylamino]benzoyl]amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.