3-Thiophenecarboxylic acid, 4-((methylphenylamino)sulfonyl)-, methyl ester
TL;DR: 3-Thiophenecarboxylic acid, 4-((methylphenylamino)sulfonyl)-, methyl ester (CAS 140947-41-7) is a chemical compound with molecular formula C13H13NO4S2 and molecular weight 311.0286 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-[methyl(phenyl)sulfamoyl]thiophene-3-carboxylate
Also Known As: Methyl 4-((methylphenylamino)sulfonyl)-3-thiophenecarboxylate, methyl 4-[methyl(phenyl)sulfamoyl]thiophene-3-carboxylate, 3-Thiophenecarboxylic acid, 4-((methylphenylamino)sulfonyl)-, methyl ester, 4-(Methylphenylsulfamoyl)thiophene-3-carboxylic acid methyl ester
Technical Specifications
| Molecular Formula | C13H13NO4S2 |
| Molecular Weight | 311.0286 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 100.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 311.0286 Da |
| Heavy Atoms | 20 |
| Complexity | 440.0 |
| SMILES | CN(C1=CC=CC=C1)S(=O)(=O)C2=CSC=C2C(=O)OC |
| InChIKey | IRSSBURJSNBCGB-UHFFFAOYSA-N |
Chemical Property Profile of 3-Thiophenecarboxylic acid, 4-((methylphenylamino)sulfonyl)-, methyl ester
Property Insights of 3-Thiophenecarboxylic acid, 4-((methylphenylamino)sulfonyl)-, methyl ester
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Thiophenecarboxylic acid, 4-((methylphenylamino)sulfonyl)-, methyl ester. The TPSA of 100.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Thiophenecarboxylic acid, 4-((methylphenylamino)sulfonyl)-, methyl ester. Following Lipinski's Rule of Five, 3-Thiophenecarboxylic acid, 4-((methylphenylamino)sulfonyl)-, methyl ester has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Thiophenecarboxylic acid, 4-((methylphenylamino)sulfonyl)-, methyl ester?
The CAS number of 3-Thiophenecarboxylic acid, 4-((methylphenylamino)sulfonyl)-, methyl ester is 140947-41-7.
What is the molecular formula of 3-Thiophenecarboxylic acid, 4-((methylphenylamino)sulfonyl)-, methyl ester?
The molecular formula of 3-Thiophenecarboxylic acid, 4-((methylphenylamino)sulfonyl)-, methyl ester is C13H13NO4S2.
What is the molecular weight of 3-Thiophenecarboxylic acid, 4-((methylphenylamino)sulfonyl)-, methyl ester?
The molecular weight of 3-Thiophenecarboxylic acid, 4-((methylphenylamino)sulfonyl)-, methyl ester is 311.0286 g/mol.
Where can I buy 3-Thiophenecarboxylic acid, 4-((methylphenylamino)sulfonyl)-, methyl ester?
You can request a quote for 3-Thiophenecarboxylic acid, 4-((methylphenylamino)sulfonyl)-, methyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Thiophenecarboxylic acid, 4-((methylphenylamino)sulfonyl)-, methyl ester?
Yes, CoreyChem provides custom synthesis services for 3-Thiophenecarboxylic acid, 4-((methylphenylamino)sulfonyl)-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.