![methyl 2-{[N-(4-ethylphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate structure](/static/products/4462/446259-23-0.webp)
methyl 2-{[N-(4-ethylphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate
TL;DR: methyl 2-{[N-(4-ethylphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate (CAS 446259-23-0) is a chemical compound with molecular formula C19H22N2O5S and molecular weight 390.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[2-(4-ethyl-N-methylsulfonylanilino)acetyl]amino]benzoate
Also Known As: methyl 2-{[N-(4-ethylphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate, methyl 2-(2-(N-(4-ethylphenyl)methylsulfonamido)acetamido)benzoate, methyl 2-[[2-(4-ethyl-N-methylsulfonylanilino)acetyl]amino]benzoate, methyl 2-{2-[(4-ethylphenyl)(methylsulfonyl)amino]acetylamino}benzoate
| Molecular Formula | C19H22N2O5S |
|---|---|
| Molecular Weight | 390.12 g/mol |
| LogP | 2.4403 |
| Topological Polar Surface Area | 92.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 390.12494 |
| Heavy Atoms | 27 |
| Complexity | 923.37115 |
Chemical Identifiers
| CAS Number | 446259-23-0 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)N(CC(=O)NC2=CC=CC=C2C(=O)OC)S(=O)(=O)C |
Product Overview
methyl 2-{[N-(4-ethylphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate (CAS 446259-23-0), with molecular formula C19H22N2O5S and molecular weight 390.12 g/mol. IUPAC: methyl 2-[[2-(4-ethyl-N-methylsulfonylanilino)acetyl]amino]benzoate.
Chemical Property Profile of methyl 2-{[N-(4-ethylphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate
Property Insights of methyl 2-{[N-(4-ethylphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate
The XLogP value of 2.4403 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 2-{[N-(4-ethylphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate. The TPSA of 92.78 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-{[N-(4-ethylphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate. Following Lipinski's Rule of Five, methyl 2-{[N-(4-ethylphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate has 1 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 2-{[N-(4-ethylphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate?
The CAS number of methyl 2-{[N-(4-ethylphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate is 446259-23-0.
What is the molecular formula of methyl 2-{[N-(4-ethylphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate?
The molecular formula of methyl 2-{[N-(4-ethylphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate is C19H22N2O5S.
What is the molecular weight of methyl 2-{[N-(4-ethylphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate?
The molecular weight of methyl 2-{[N-(4-ethylphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate is 390.12 g/mol.
Where can I buy methyl 2-{[N-(4-ethylphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate?
You can request a quote for methyl 2-{[N-(4-ethylphenyl)-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 methyl 2-{[N-(4-ethylphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-{[N-(4-ethylphenyl)-N-(methylsulfonyl)glycyl]amino}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.