![3-[3-(Diethylsulfamoyl)-4-methylbenzamido]benzoic acid structure](/static/products/5230/5230-04-6.webp)
3-[3-(Diethylsulfamoyl)-4-methylbenzamido]benzoic acid
TL;DR: 3-[3-(Diethylsulfamoyl)-4-methylbenzamido]benzoic acid (CAS 5230-04-6) 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.
3-[[3-(diethylsulfamoyl)-4-methylbenzoyl]amino]benzoic acid
Also Known As: BIM-0012407.P001, 3-({3-[(diethylamino)sulfonyl]-4-methylbenzoyl}amino)benzoic acid, 3-[3-(Diethylsulfamoyl)-4-methylbenzamido]benzoic acid, 3-[[3-(diethylsulfamoyl)-4-methylbenzoyl]amino]benzoic acid, 3-{[3-(diethylsulfamoyl)-4-methylbenzene]amido}benzoic acid
| Molecular Formula | C19H22N2O5S |
|---|---|
| Molecular Weight | 390.12 g/mol |
| LogP | 2.97602 |
| Topological Polar Surface Area | 103.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 390.12494 |
| Heavy Atoms | 27 |
| Complexity | 965.81537 |
Chemical Identifiers
| CAS Number | 5230-04-6 |
|---|---|
| SMILES | CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)NC2=CC=CC(=C2)C(=O)O)C |
Product Overview
3-[3-(Diethylsulfamoyl)-4-methylbenzamido]benzoic acid (CAS 5230-04-6), with molecular formula C19H22N2O5S and molecular weight 390.12 g/mol. IUPAC: 3-[[3-(diethylsulfamoyl)-4-methylbenzoyl]amino]benzoic acid.
Chemical Property Profile of 3-[3-(Diethylsulfamoyl)-4-methylbenzamido]benzoic acid
Property Insights of 3-[3-(Diethylsulfamoyl)-4-methylbenzamido]benzoic acid
The XLogP value of 2.97602 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[3-(Diethylsulfamoyl)-4-methylbenzamido]benzoic acid. The TPSA of 103.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[3-(Diethylsulfamoyl)-4-methylbenzamido]benzoic acid. Following Lipinski's Rule of Five, 3-[3-(Diethylsulfamoyl)-4-methylbenzamido]benzoic acid has 2 hydrogen bond donor(s) and 4 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 3-[3-(Diethylsulfamoyl)-4-methylbenzamido]benzoic acid?
The CAS number of 3-[3-(Diethylsulfamoyl)-4-methylbenzamido]benzoic acid is 5230-04-6.
What is the molecular formula of 3-[3-(Diethylsulfamoyl)-4-methylbenzamido]benzoic acid?
The molecular formula of 3-[3-(Diethylsulfamoyl)-4-methylbenzamido]benzoic acid is C19H22N2O5S.
What is the molecular weight of 3-[3-(Diethylsulfamoyl)-4-methylbenzamido]benzoic acid?
The molecular weight of 3-[3-(Diethylsulfamoyl)-4-methylbenzamido]benzoic acid is 390.12 g/mol.
Where can I buy 3-[3-(Diethylsulfamoyl)-4-methylbenzamido]benzoic acid?
You can request a quote for 3-[3-(Diethylsulfamoyl)-4-methylbenzamido]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[3-(Diethylsulfamoyl)-4-methylbenzamido]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[3-(Diethylsulfamoyl)-4-methylbenzamido]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.