5-(2H-1,3-benzodioxol-5-yl)-N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
5-(2H-1,3-benzodioxol-5-yl)-N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
5-(2H-1,3-benzodioxol-5-yl)-N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | A0005403 |
| Compound Name: | 5-(2H-1,3-benzodioxol-5-yl)-N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 499.47 |
| Molecular Formula: | C23 H16 F3 N5 O3 S |
| Smiles: | CCc1c(C#N)c(NC(c2cc3nc(cc(C(F)(F)F)n3n2)c2ccc3c(c2)OCO3)=O)sc1C |
| Stereo: | ACHIRAL |
| logP: | 5.4946 |
| logD: | 3.8484 |
| logSw: | -5.5414 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.455 |
| InChI Key: | KOXQBYVPAPWXLC-UHFFFAOYSA-N |