![ethyl 2-{[N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate structure](/static/products/3333/333319-97-4.webp)
ethyl 2-{[N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate
TL;DR: ethyl 2-{[N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate (CAS 333319-97-4) is a chemical compound with molecular formula C19H21ClN2O6S and molecular weight 440.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-(5-chloro-2-methoxy-N-methylsulfonylanilino)acetyl]amino]benzoate
Also Known As: BAS 02177481, AB00103306-01, ethyl 2-{[N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate, ethyl 2-[[2-(5-chloro-2-methoxy-N-methylsulfonylanilino)acetyl]amino]benzoate, ethyl 2-({[5-chloro-2-methoxy(methylsulfonyl)anilino]acetyl}amino)benzoate
| Molecular Formula | C19H21ClN2O6S |
|---|---|
| Molecular Weight | 440.08 g/mol |
| LogP | 2.93 |
| Topological Polar Surface Area | 102.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 440.08087 |
| Heavy Atoms | 29 |
| Complexity | 1009.509 |
Chemical Identifiers
| CAS Number | 333319-97-4 |
|---|---|
| SMILES | CCOC(=O)C1=CC=CC=C1NC(=O)CN(C2=C(C=CC(=C2)Cl)OC)S(=O)(=O)C |
Product Overview
ethyl 2-{[N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate (CAS 333319-97-4), with molecular formula C19H21ClN2O6S and molecular weight 440.08 g/mol. IUPAC: ethyl 2-[[2-(5-chloro-2-methoxy-N-methylsulfonylanilino)acetyl]amino]benzoate.
Chemical Property Profile of ethyl 2-{[N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate
Property Insights of ethyl 2-{[N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate
The XLogP value of 2.93 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl 2-{[N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate. The TPSA of 102.01 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 2-{[N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate. Following Lipinski's Rule of Five, ethyl 2-{[N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate has 1 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 ethyl 2-{[N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate?
The CAS number of ethyl 2-{[N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate is 333319-97-4.
What is the molecular formula of ethyl 2-{[N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate?
The molecular formula of ethyl 2-{[N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate is C19H21ClN2O6S.
What is the molecular weight of ethyl 2-{[N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate?
The molecular weight of ethyl 2-{[N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate is 440.08 g/mol.
Where can I buy ethyl 2-{[N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate?
You can request a quote for ethyl 2-{[N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)glycyl]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 2-{[N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 2-{[N-(5-chloro-2-methoxyphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.