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Ethyl 2,4-dichloro-5-[[(3,5-dimethylphenyl)amino]sulfonyl]benzoate
TL;DR: Ethyl 2,4-dichloro-5-[[(3,5-dimethylphenyl)amino]sulfonyl]benzoate (CAS 438613-26-4) is a chemical compound with molecular formula C17H17Cl2NO4S and molecular weight 401.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2,4-dichloro-5-[(3,5-dimethylphenyl)sulfamoyl]benzoate
Also Known As: ethyl 2,4-dichloro-5-[(3,5-dimethylphenyl)sulfamoyl]benzoate, Ethyl 2,4-dichloro-5-[[(3,5-dimethylphenyl)amino]sulfonyl]benzoate, ethyl 2,4-dichloro-5-[(3,5-dimethylanilino)sulfonyl]benzoate, Ethyl 2,4-dichloro-5-(((3,5-dimethylphenyl)amino)sulfonyl)benzoate, RefChem:342215
| Molecular Formula | C17H17Cl2NO4S |
|---|---|
| Molecular Weight | 401.03 g/mol |
| LogP | 4.58774 |
| Topological Polar Surface Area | 72.47 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 401.02554 |
| Heavy Atoms | 25 |
| Complexity | 906.23535 |
Chemical Identifiers
| CAS Number | 438613-26-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC(=C(C=C1Cl)Cl)S(=O)(=O)NC2=CC(=CC(=C2)C)C |
Product Overview
Ethyl 2,4-dichloro-5-[[(3,5-dimethylphenyl)amino]sulfonyl]benzoate (CAS 438613-26-4), with molecular formula C17H17Cl2NO4S and molecular weight 401.03 g/mol. IUPAC: ethyl 2,4-dichloro-5-[(3,5-dimethylphenyl)sulfamoyl]benzoate.
Chemical Property Profile of Ethyl 2,4-dichloro-5-[[(3,5-dimethylphenyl)amino]sulfonyl]benzoate
Property Insights of Ethyl 2,4-dichloro-5-[[(3,5-dimethylphenyl)amino]sulfonyl]benzoate
The XLogP value of 4.58774 indicates that Ethyl 2,4-dichloro-5-[[(3,5-dimethylphenyl)amino]sulfonyl]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.47 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2,4-dichloro-5-[[(3,5-dimethylphenyl)amino]sulfonyl]benzoate. Following Lipinski's Rule of Five, Ethyl 2,4-dichloro-5-[[(3,5-dimethylphenyl)amino]sulfonyl]benzoate has 1 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 Ethyl 2,4-dichloro-5-[[(3,5-dimethylphenyl)amino]sulfonyl]benzoate?
The CAS number of Ethyl 2,4-dichloro-5-[[(3,5-dimethylphenyl)amino]sulfonyl]benzoate is 438613-26-4.
What is the molecular formula of Ethyl 2,4-dichloro-5-[[(3,5-dimethylphenyl)amino]sulfonyl]benzoate?
The molecular formula of Ethyl 2,4-dichloro-5-[[(3,5-dimethylphenyl)amino]sulfonyl]benzoate is C17H17Cl2NO4S.
What is the molecular weight of Ethyl 2,4-dichloro-5-[[(3,5-dimethylphenyl)amino]sulfonyl]benzoate?
The molecular weight of Ethyl 2,4-dichloro-5-[[(3,5-dimethylphenyl)amino]sulfonyl]benzoate is 401.03 g/mol.
Where can I buy Ethyl 2,4-dichloro-5-[[(3,5-dimethylphenyl)amino]sulfonyl]benzoate?
You can request a quote for Ethyl 2,4-dichloro-5-[[(3,5-dimethylphenyl)amino]sulfonyl]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2,4-dichloro-5-[[(3,5-dimethylphenyl)amino]sulfonyl]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2,4-dichloro-5-[[(3,5-dimethylphenyl)amino]sulfonyl]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.