![methyl 2-({N-[(4-methoxyphenyl)sulfonyl]alanyl}amino)benzoate structure](/static/products/1164/1164097-29-3.webp)
methyl 2-({N-[(4-methoxyphenyl)sulfonyl]alanyl}amino)benzoate
TL;DR: methyl 2-({N-[(4-methoxyphenyl)sulfonyl]alanyl}amino)benzoate (CAS 1164097-29-3) is a chemical compound with molecular formula C18H20N2O6S and molecular weight 392.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[2-[(4-methoxyphenyl)sulfonylamino]propanoylamino]benzoate
Also Known As: methyl 2-({N-[(4-methoxyphenyl)sulfonyl]alanyl}amino)benzoate, methyl 2-(2-(4-methoxyphenylsulfonamido)propanamido)benzoate, methyl 2-[2-[(4-methoxyphenyl)sulfonylamino]propanoylamino]benzoate
| Molecular Formula | C18H20N2O6S |
|---|---|
| Molecular Weight | 392.10 g/mol |
| LogP | 1.7873 |
| Topological Polar Surface Area | 110.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 392.10422 |
| Heavy Atoms | 27 |
| Complexity | 925.123 |
Chemical Identifiers
| CAS Number | 1164097-29-3 |
|---|---|
| SMILES | CC(C(=O)NC1=CC=CC=C1C(=O)OC)NS(=O)(=O)C2=CC=C(C=C2)OC |
Product Overview
methyl 2-({N-[(4-methoxyphenyl)sulfonyl]alanyl}amino)benzoate (CAS 1164097-29-3), with molecular formula C18H20N2O6S and molecular weight 392.10 g/mol. IUPAC: methyl 2-[2-[(4-methoxyphenyl)sulfonylamino]propanoylamino]benzoate.
Chemical Property Profile of methyl 2-({N-[(4-methoxyphenyl)sulfonyl]alanyl}amino)benzoate
Property Insights of methyl 2-({N-[(4-methoxyphenyl)sulfonyl]alanyl}amino)benzoate
The XLogP value of 1.7873 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 2-({N-[(4-methoxyphenyl)sulfonyl]alanyl}amino)benzoate. The TPSA of 110.8 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-({N-[(4-methoxyphenyl)sulfonyl]alanyl}amino)benzoate. Following Lipinski's Rule of Five, methyl 2-({N-[(4-methoxyphenyl)sulfonyl]alanyl}amino)benzoate has 2 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 methyl 2-({N-[(4-methoxyphenyl)sulfonyl]alanyl}amino)benzoate?
The CAS number of methyl 2-({N-[(4-methoxyphenyl)sulfonyl]alanyl}amino)benzoate is 1164097-29-3.
What is the molecular formula of methyl 2-({N-[(4-methoxyphenyl)sulfonyl]alanyl}amino)benzoate?
The molecular formula of methyl 2-({N-[(4-methoxyphenyl)sulfonyl]alanyl}amino)benzoate is C18H20N2O6S.
What is the molecular weight of methyl 2-({N-[(4-methoxyphenyl)sulfonyl]alanyl}amino)benzoate?
The molecular weight of methyl 2-({N-[(4-methoxyphenyl)sulfonyl]alanyl}amino)benzoate is 392.10 g/mol.
Where can I buy methyl 2-({N-[(4-methoxyphenyl)sulfonyl]alanyl}amino)benzoate?
You can request a quote for methyl 2-({N-[(4-methoxyphenyl)sulfonyl]alanyl}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-methoxyphenyl)sulfonyl]alanyl}amino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-({N-[(4-methoxyphenyl)sulfonyl]alanyl}amino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.