methyl 2-({N-ethyl-N-[(4-methylphenyl)sulfonyl]glycyl}amino)benzoate
TL;DR: methyl 2-({N-ethyl-N-[(4-methylphenyl)sulfonyl]glycyl}amino)benzoate (CAS 710979-36-5) 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-[ethyl-(4-methylphenyl)sulfonylamino]acetyl]amino]benzoate
Also Known As: methyl 2-({N-ethyl-N-[(4-methylphenyl)sulfonyl]glycyl}amino)benzoate, methyl 2-(2-(N-ethyl-4-methylphenylsulfonamido)acetamido)benzoate, methyl 2-[[2-[ethyl-(4-methylphenyl)sulfonylamino]acetyl]amino]benzoate, METHYL 2-[2-(N-ETHYL4-METHYLBENZENESULFONAMIDO)ACETAMIDO]BENZOATE
| Molecular Formula | C19H22N2O5S |
|---|---|
| Molecular Weight | 390.12 g/mol |
| LogP | 2.43092 |
| 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 | 710979-36-5 |
|---|---|
| SMILES | CCN(CC(=O)NC1=CC=CC=C1C(=O)OC)S(=O)(=O)C2=CC=C(C=C2)C |
Product Overview
methyl 2-({N-ethyl-N-[(4-methylphenyl)sulfonyl]glycyl}amino)benzoate (CAS 710979-36-5), with molecular formula C19H22N2O5S and molecular weight 390.12 g/mol. IUPAC: methyl 2-[[2-[ethyl-(4-methylphenyl)sulfonylamino]acetyl]amino]benzoate.
Chemical Property Profile of methyl 2-({N-ethyl-N-[(4-methylphenyl)sulfonyl]glycyl}amino)benzoate
Property Insights of methyl 2-({N-ethyl-N-[(4-methylphenyl)sulfonyl]glycyl}amino)benzoate
The XLogP value of 2.43092 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 2-({N-ethyl-N-[(4-methylphenyl)sulfonyl]glycyl}amino)benzoate. The TPSA of 92.78 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-({N-ethyl-N-[(4-methylphenyl)sulfonyl]glycyl}amino)benzoate. Following Lipinski's Rule of Five, methyl 2-({N-ethyl-N-[(4-methylphenyl)sulfonyl]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-ethyl-N-[(4-methylphenyl)sulfonyl]glycyl}amino)benzoate?
The CAS number of methyl 2-({N-ethyl-N-[(4-methylphenyl)sulfonyl]glycyl}amino)benzoate is 710979-36-5.
What is the molecular formula of methyl 2-({N-ethyl-N-[(4-methylphenyl)sulfonyl]glycyl}amino)benzoate?
The molecular formula of methyl 2-({N-ethyl-N-[(4-methylphenyl)sulfonyl]glycyl}amino)benzoate is C19H22N2O5S.
What is the molecular weight of methyl 2-({N-ethyl-N-[(4-methylphenyl)sulfonyl]glycyl}amino)benzoate?
The molecular weight of methyl 2-({N-ethyl-N-[(4-methylphenyl)sulfonyl]glycyl}amino)benzoate is 390.12 g/mol.
Where can I buy methyl 2-({N-ethyl-N-[(4-methylphenyl)sulfonyl]glycyl}amino)benzoate?
You can request a quote for methyl 2-({N-ethyl-N-[(4-methylphenyl)sulfonyl]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-ethyl-N-[(4-methylphenyl)sulfonyl]glycyl}amino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-({N-ethyl-N-[(4-methylphenyl)sulfonyl]glycyl}amino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.