N-(cyanomethyl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
Chemical Structure Depiction of
N-(cyanomethyl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
N-(cyanomethyl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
Compound characteristics
| Compound ID: | Y500-0552 |
| Compound Name: | N-(cyanomethyl)-5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide |
| Molecular Weight: | 345.28 |
| Molecular Formula: | C16 H10 F3 N5 O |
| Smiles: | C(C#N)NC(c1cnn2c(cc(c3ccccc3)nc12)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0068 |
| logD: | 3.0068 |
| logSw: | -3.4698 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.186 |
| InChI Key: | DGOVLBYXRTZFIS-UHFFFAOYSA-N |