![4,5-Dimethyl-2-[(3-methylbenzoyl)amino]-3-thiophenecarboxylic acid structure](/static/products/3129/312940-71-9.webp)
4,5-Dimethyl-2-[(3-methylbenzoyl)amino]-3-thiophenecarboxylic acid
TL;DR: 4,5-Dimethyl-2-[(3-methylbenzoyl)amino]-3-thiophenecarboxylic acid (CAS 312940-71-9) is a chemical compound with molecular formula C15H15NO3S and molecular weight 289.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dimethyl-2-[(3-methylbenzoyl)amino]thiophene-3-carboxylic acid
Also Known As: AE-848/37051056, 4,5-dimethyl-2-[(3-methylbenzoyl)amino]-3-thiophenecarboxylic acid, 4,5-dimethyl-2-[(3-methylbenzoyl)amino]thiophene-3-carboxylic acid, 4,5-DIMETHYL-2-(3-METHYLBENZAMIDO)THIOPHENE-3-CARBOXYLIC ACID, 4,5-dimethyl-2-{[(3-methylphenyl)carbonyl]amino}thiophene-3-carboxylic acid
| Molecular Formula | C15H15NO3S |
|---|---|
| Molecular Weight | 289.08 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 94.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 289.07727 |
| Heavy Atoms | 20 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 312940-71-9 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)NC2=C(C(=C(S2)C)C)C(=O)O |
| InChIKey | JCEZHNZBOGZOGH-UHFFFAOYSA-N |
Product Overview
4,5-Dimethyl-2-[(3-methylbenzoyl)amino]-3-thiophenecarboxylic acid (CAS 312940-71-9), with molecular formula C15H15NO3S and molecular weight 289.08 g/mol. IUPAC: 4,5-dimethyl-2-[(3-methylbenzoyl)amino]thiophene-3-carboxylic acid.
Chemical Property Profile of 4,5-Dimethyl-2-[(3-methylbenzoyl)amino]-3-thiophenecarboxylic acid
Property Insights of 4,5-Dimethyl-2-[(3-methylbenzoyl)amino]-3-thiophenecarboxylic acid
The XLogP value of 4.0 indicates that 4,5-Dimethyl-2-[(3-methylbenzoyl)amino]-3-thiophenecarboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,5-Dimethyl-2-[(3-methylbenzoyl)amino]-3-thiophenecarboxylic acid. Following Lipinski's Rule of Five, 4,5-Dimethyl-2-[(3-methylbenzoyl)amino]-3-thiophenecarboxylic 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 4,5-Dimethyl-2-[(3-methylbenzoyl)amino]-3-thiophenecarboxylic acid?
The CAS number of 4,5-Dimethyl-2-[(3-methylbenzoyl)amino]-3-thiophenecarboxylic acid is 312940-71-9.
What is the molecular formula of 4,5-Dimethyl-2-[(3-methylbenzoyl)amino]-3-thiophenecarboxylic acid?
The molecular formula of 4,5-Dimethyl-2-[(3-methylbenzoyl)amino]-3-thiophenecarboxylic acid is C15H15NO3S.
What is the molecular weight of 4,5-Dimethyl-2-[(3-methylbenzoyl)amino]-3-thiophenecarboxylic acid?
The molecular weight of 4,5-Dimethyl-2-[(3-methylbenzoyl)amino]-3-thiophenecarboxylic acid is 289.08 g/mol.
Where can I buy 4,5-Dimethyl-2-[(3-methylbenzoyl)amino]-3-thiophenecarboxylic acid?
You can request a quote for 4,5-Dimethyl-2-[(3-methylbenzoyl)amino]-3-thiophenecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Dimethyl-2-[(3-methylbenzoyl)amino]-3-thiophenecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Dimethyl-2-[(3-methylbenzoyl)amino]-3-thiophenecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.