methyl 2-(4-(N,4-dimethylphenylsulfonamido)benzamido)benzoate
TL;DR: methyl 2-(4-(N,4-dimethylphenylsulfonamido)benzamido)benzoate (CAS 693811-61-9) is a chemical compound with molecular formula C23H22N2O5S and molecular weight 438.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[4-[methyl-(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate
Also Known As: methyl 2-(4-(N,4-dimethylphenylsulfonamido)benzamido)benzoate, methyl 2-{[(4-{methyl[(4-methylphenyl)sulfonyl]amino}phenyl)carbonyl]amino}benzoate, methyl 2-[[4-[methyl-(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate
| Molecular Formula | C23H22N2O5S |
|---|---|
| Molecular Weight | 438.12 g/mol |
| LogP | 3.85902 |
| Topological Polar Surface Area | 92.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 438.12494 |
| Heavy Atoms | 31 |
| Complexity | 1203.474 |
Chemical Identifiers
| CAS Number | 693811-61-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)NC3=CC=CC=C3C(=O)OC |
Product Overview
methyl 2-(4-(N,4-dimethylphenylsulfonamido)benzamido)benzoate (CAS 693811-61-9), with molecular formula C23H22N2O5S and molecular weight 438.12 g/mol. IUPAC: methyl 2-[[4-[methyl-(4-methylphenyl)sulfonylamino]benzoyl]amino]benzoate.
Chemical Property Profile of methyl 2-(4-(N,4-dimethylphenylsulfonamido)benzamido)benzoate
Property Insights of methyl 2-(4-(N,4-dimethylphenylsulfonamido)benzamido)benzoate
The XLogP value of 3.85902 indicates that methyl 2-(4-(N,4-dimethylphenylsulfonamido)benzamido)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.78 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 2-(4-(N,4-dimethylphenylsulfonamido)benzamido)benzoate. Following Lipinski's Rule of Five, methyl 2-(4-(N,4-dimethylphenylsulfonamido)benzamido)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-(4-(N,4-dimethylphenylsulfonamido)benzamido)benzoate?
The CAS number of methyl 2-(4-(N,4-dimethylphenylsulfonamido)benzamido)benzoate is 693811-61-9.
What is the molecular formula of methyl 2-(4-(N,4-dimethylphenylsulfonamido)benzamido)benzoate?
The molecular formula of methyl 2-(4-(N,4-dimethylphenylsulfonamido)benzamido)benzoate is C23H22N2O5S.
What is the molecular weight of methyl 2-(4-(N,4-dimethylphenylsulfonamido)benzamido)benzoate?
The molecular weight of methyl 2-(4-(N,4-dimethylphenylsulfonamido)benzamido)benzoate is 438.12 g/mol.
Where can I buy methyl 2-(4-(N,4-dimethylphenylsulfonamido)benzamido)benzoate?
You can request a quote for methyl 2-(4-(N,4-dimethylphenylsulfonamido)benzamido)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-(4-(N,4-dimethylphenylsulfonamido)benzamido)benzoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-(4-(N,4-dimethylphenylsulfonamido)benzamido)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.