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Methyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)benzoate
TL;DR: Methyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)benzoate (CAS 641601-57-2) is a chemical compound with molecular formula C17H18N2O5S and molecular weight 362.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[2-[methyl(methylsulfonyl)amino]benzoyl]amino]benzoate
Also Known As: VU0050270-5, methyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)benzoate, methyl 2-(2-(N-methylmethylsulfonamido)benzamido)benzoate, methyl 2-[({2-[methyl(methylsulfonyl)amino]phenyl}carbonyl)amino]benzoate, methyl 2-[[2-[methyl(methylsulfonyl)amino]benzoyl]amino]benzoate
| Molecular Formula | C17H18N2O5S |
|---|---|
| Molecular Weight | 362.09 g/mol |
| LogP | 2.1213 |
| Topological Polar Surface Area | 92.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 362.09363 |
| Heavy Atoms | 25 |
| Complexity | 908.75916 |
Chemical Identifiers
| CAS Number | 641601-57-2 |
|---|---|
| SMILES | CN(C1=CC=CC=C1C(=O)NC2=CC=CC=C2C(=O)OC)S(=O)(=O)C |
Product Overview
Methyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)benzoate (CAS 641601-57-2), with molecular formula C17H18N2O5S and molecular weight 362.09 g/mol. IUPAC: methyl 2-[[2-[methyl(methylsulfonyl)amino]benzoyl]amino]benzoate.
Chemical Property Profile of Methyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)benzoate
Property Insights of Methyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)benzoate
The XLogP value of 2.1213 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)benzoate. The TPSA of 92.78 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)benzoate. Following Lipinski's Rule of Five, Methyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}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-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)benzoate?
The CAS number of Methyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)benzoate is 641601-57-2.
What is the molecular formula of Methyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)benzoate?
The molecular formula of Methyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)benzoate is C17H18N2O5S.
What is the molecular weight of Methyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)benzoate?
The molecular weight of Methyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)benzoate is 362.09 g/mol.
Where can I buy Methyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)benzoate?
You can request a quote for Methyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}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-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-({2-[methyl(methylsulfonyl)amino]benzoyl}amino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.