4,5-Dimethyl-2-(2-methylpropanamido)thiophene-3-carboxylic acid
TL;DR: 4,5-Dimethyl-2-(2-methylpropanamido)thiophene-3-carboxylic acid (CAS 312940-41-3) is a chemical compound with molecular formula C11H15NO3S and molecular weight 241.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dimethyl-2-(2-methylpropanoylamino)thiophene-3-carboxylic acid
Also Known As: TimTec1_007178, 4,5-dimethyl-2-(2-methylpropanamido)thiophene-3-carboxylic acid, 2-(isobutyrylamino)-4,5-dimethyl-3-thiophenecarboxylic acid, 2-Isobutyramido-4,5-dimethylthiophene-3-carboxylic acid, BAS 02055392
| Molecular Formula | C11H15NO3S |
|---|---|
| Molecular Weight | 241.08 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 94.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 241.07727 |
| Heavy Atoms | 16 |
| Complexity | 293.0 |
Chemical Identifiers
| CAS Number | 312940-41-3 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)O)NC(=O)C(C)C)C |
| InChIKey | ZERSOEDAIIYKFS-UHFFFAOYSA-N |
Product Overview
4,5-Dimethyl-2-(2-methylpropanamido)thiophene-3-carboxylic acid (CAS 312940-41-3), with molecular formula C11H15NO3S and molecular weight 241.08 g/mol. IUPAC: 4,5-dimethyl-2-(2-methylpropanoylamino)thiophene-3-carboxylic acid.
Chemical Property Profile of 4,5-Dimethyl-2-(2-methylpropanamido)thiophene-3-carboxylic acid
Property Insights of 4,5-Dimethyl-2-(2-methylpropanamido)thiophene-3-carboxylic acid
The XLogP value of 3.0 indicates that 4,5-Dimethyl-2-(2-methylpropanamido)thiophene-3-carboxylic 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-(2-methylpropanamido)thiophene-3-carboxylic acid. Following Lipinski's Rule of Five, 4,5-Dimethyl-2-(2-methylpropanamido)thiophene-3-carboxylic 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-(2-methylpropanamido)thiophene-3-carboxylic acid?
The CAS number of 4,5-Dimethyl-2-(2-methylpropanamido)thiophene-3-carboxylic acid is 312940-41-3.
What is the molecular formula of 4,5-Dimethyl-2-(2-methylpropanamido)thiophene-3-carboxylic acid?
The molecular formula of 4,5-Dimethyl-2-(2-methylpropanamido)thiophene-3-carboxylic acid is C11H15NO3S.
What is the molecular weight of 4,5-Dimethyl-2-(2-methylpropanamido)thiophene-3-carboxylic acid?
The molecular weight of 4,5-Dimethyl-2-(2-methylpropanamido)thiophene-3-carboxylic acid is 241.08 g/mol.
Where can I buy 4,5-Dimethyl-2-(2-methylpropanamido)thiophene-3-carboxylic acid?
You can request a quote for 4,5-Dimethyl-2-(2-methylpropanamido)thiophene-3-carboxylic 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-(2-methylpropanamido)thiophene-3-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Dimethyl-2-(2-methylpropanamido)thiophene-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.