N-{3,5-dimethyl-1-[(3-phenoxyphenyl)methyl]-1H-pyrazol-4-yl}-5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Chemical Structure Depiction of
N-{3,5-dimethyl-1-[(3-phenoxyphenyl)methyl]-1H-pyrazol-4-yl}-5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
N-{3,5-dimethyl-1-[(3-phenoxyphenyl)methyl]-1H-pyrazol-4-yl}-5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | Y508-7131 |
| Compound Name: | N-{3,5-dimethyl-1-[(3-phenoxyphenyl)methyl]-1H-pyrazol-4-yl}-5-phenyl-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide |
| Molecular Weight: | 586.62 |
| Molecular Formula: | C32 H29 F3 N6 O2 |
| Smiles: | Cc1c(c(C)n(Cc2cccc(c2)Oc2ccccc2)n1)NC(c1cc2NC(CC(C(F)(F)F)n2n1)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 5.7319 |
| logD: | 5.7318 |
| logSw: | -5.4863 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.491 |
| InChI Key: | KQMVSZIIGLJNTK-UHFFFAOYSA-N |