4-Methoxy-3-(methylsulfamoyl)benzoic acid
TL;DR: 4-Methoxy-3-(methylsulfamoyl)benzoic acid (CAS 94805-51-3) is a chemical compound with molecular formula C9H11NO5S and molecular weight 245.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-3-(methylsulfamoyl)benzoic acid
Also Known As: 4-methoxy-3-(methylsulfamoyl)benzoic acid, 4-Methoxy-3-methylsulfamoyl-benzoic acid, 2-Hydroxyisonicotinonitrile, 4-methoxy-3-(n-methylsulfamoyl)benzoic acid, 4-methoxy-3-[(methylamino)sulfonyl]benzoic acid
| Molecular Formula | C9H11NO5S |
|---|---|
| Molecular Weight | 245.04 g/mol |
| LogP | 0.3015 |
| Topological Polar Surface Area | 92.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 245.0358 |
| Heavy Atoms | 16 |
| Complexity | 508.63068 |
Chemical Identifiers
| CAS Number | 94805-51-3 |
|---|---|
| SMILES | CNS(=O)(=O)C1=C(C=CC(=C1)C(=O)O)OC |
Product Overview
4-Methoxy-3-(methylsulfamoyl)benzoic acid (CAS 94805-51-3), with molecular formula C9H11NO5S and molecular weight 245.04 g/mol. IUPAC: 4-methoxy-3-(methylsulfamoyl)benzoic acid.
Chemical Property Profile of 4-Methoxy-3-(methylsulfamoyl)benzoic acid
Property Insights of 4-Methoxy-3-(methylsulfamoyl)benzoic acid
The XLogP value of 0.3015 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methoxy-3-(methylsulfamoyl)benzoic acid. The TPSA of 92.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methoxy-3-(methylsulfamoyl)benzoic acid. Following Lipinski's Rule of Five, 4-Methoxy-3-(methylsulfamoyl)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 4-Methoxy-3-(methylsulfamoyl)benzoic acid?
The CAS number of 4-Methoxy-3-(methylsulfamoyl)benzoic acid is 94805-51-3.
What is the molecular formula of 4-Methoxy-3-(methylsulfamoyl)benzoic acid?
The molecular formula of 4-Methoxy-3-(methylsulfamoyl)benzoic acid is C9H11NO5S.
What is the molecular weight of 4-Methoxy-3-(methylsulfamoyl)benzoic acid?
The molecular weight of 4-Methoxy-3-(methylsulfamoyl)benzoic acid is 245.04 g/mol.
Where can I buy 4-Methoxy-3-(methylsulfamoyl)benzoic acid?
You can request a quote for 4-Methoxy-3-(methylsulfamoyl)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methoxy-3-(methylsulfamoyl)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Methoxy-3-(methylsulfamoyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.