N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide
TL;DR: N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide (CAS 1005618-32-5) is a chemical compound with molecular formula C13H11F3N4OS and molecular weight 328.06058 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3-cyano-4,5-dimethylthiophen-2-yl)-1-methyl-3-(trifluoromethyl)pyrazole-5-carboxamide
Also Known As: N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide, N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide, N-(3-CYANO-4,5-DIMETHYL-2-THIENYL)-1-METHYL-3-(TRIFLUOROMETHYL)-1H-PYRAZOLE-5-CARBOXAMIDE, N-(3-cyano-4,5-dimethylthiophen-2-yl)-1-methyl-3-(trifluoromethyl)-1H-pyrazole-5-carboxamide
Technical Specifications
| Molecular Formula | C13H11F3N4OS |
| Molecular Weight | 328.06058 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 99.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 328.06058 Da |
| Heavy Atoms | 22 |
| Complexity | 491.0 |
| SMILES | CC1=C(SC(=C1C#N)NC(=O)C2=CC(=NN2C)C(F)(F)F)C |
| InChIKey | KUONPQGTXJBIAG-UHFFFAOYSA-N |
Chemical Property Profile of N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide
Property Insights of N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide
The XLogP value of 3.4 indicates that N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide. Following Lipinski's Rule of Five, N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide 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 N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide?
The CAS number of N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide is 1005618-32-5.
What is the molecular formula of N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide?
The molecular formula of N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide is C13H11F3N4OS.
What is the molecular weight of N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide?
The molecular weight of N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide is 328.06058 g/mol.
Where can I buy N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide?
You can request a quote for N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide?
Yes, CoreyChem provides custom synthesis services for N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.