2-(3-(Trifluoromethyl)phenyl)-1,3-thiazole-4-carboxylic acid
TL;DR: 2-(3-(Trifluoromethyl)phenyl)-1,3-thiazole-4-carboxylic acid (CAS 115311-32-5) is a chemical compound with molecular formula C11H6F3NO2S and molecular weight 273.00714 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[3-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylic acid
Also Known As: 2-[3-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylic Acid, 12F-407S, 2-(3-(Trifluoromethyl)phenyl)thiazole-4-carboxylic acid, 4-Thiazolecarboxylic acid, 2-[3-(trifluoromethyl)phenyl]-, C-4069
Technical Specifications
| Molecular Formula | C11H6F3NO2S |
| Molecular Weight | 273.00714 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 78.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 273.00714 Da |
| Heavy Atoms | 18 |
| Complexity | 324.0 |
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)C2=NC(=CS2)C(=O)O |
| InChIKey | OMMDRDBAUFWKPT-UHFFFAOYSA-N |
Chemical Property Profile of 2-(3-(Trifluoromethyl)phenyl)-1,3-thiazole-4-carboxylic acid
Property Insights of 2-(3-(Trifluoromethyl)phenyl)-1,3-thiazole-4-carboxylic acid
The XLogP value of 3.4 indicates that 2-(3-(Trifluoromethyl)phenyl)-1,3-thiazole-4-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-(Trifluoromethyl)phenyl)-1,3-thiazole-4-carboxylic acid. Following Lipinski's Rule of Five, 2-(3-(Trifluoromethyl)phenyl)-1,3-thiazole-4-carboxylic acid has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-(3-(Trifluoromethyl)phenyl)-1,3-thiazole-4-carboxylic acid?
The CAS number of 2-(3-(Trifluoromethyl)phenyl)-1,3-thiazole-4-carboxylic acid is 115311-32-5.
What is the molecular formula of 2-(3-(Trifluoromethyl)phenyl)-1,3-thiazole-4-carboxylic acid?
The molecular formula of 2-(3-(Trifluoromethyl)phenyl)-1,3-thiazole-4-carboxylic acid is C11H6F3NO2S.
What is the molecular weight of 2-(3-(Trifluoromethyl)phenyl)-1,3-thiazole-4-carboxylic acid?
The molecular weight of 2-(3-(Trifluoromethyl)phenyl)-1,3-thiazole-4-carboxylic acid is 273.00714 g/mol.
Where can I buy 2-(3-(Trifluoromethyl)phenyl)-1,3-thiazole-4-carboxylic acid?
You can request a quote for 2-(3-(Trifluoromethyl)phenyl)-1,3-thiazole-4-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(3-(Trifluoromethyl)phenyl)-1,3-thiazole-4-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 2-(3-(Trifluoromethyl)phenyl)-1,3-thiazole-4-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.