7-phenyl-2-{5-[4-(propan-2-yl)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl}-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Chemical Structure Depiction of
7-phenyl-2-{5-[4-(propan-2-yl)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl}-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
7-phenyl-2-{5-[4-(propan-2-yl)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl}-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine
Compound characteristics
| Compound ID: | Y502-3923 |
| Compound Name: | 7-phenyl-2-{5-[4-(propan-2-yl)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidin-2-yl}-7H-pyrazolo[4,3-e][1,2,4]triazolo[1,5-c]pyrimidine |
| Molecular Weight: | 543.55 |
| Molecular Formula: | C28 H24 F3 N9 |
| Smiles: | CC(C)c1ccc(cc1)C1CC(C(F)(F)F)n2c(cc(c3nc4c5cnn(c6ccccc6)c5ncn4n3)n2)N1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 6.2554 |
| logD: | 6.2547 |
| logSw: | -5.822 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.969 |
| InChI Key: | IATUIKIDGXUILK-UHFFFAOYSA-N |