{4-[3-methyl-6-(2-methylpropyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}[3-(trifluoromethyl)phenyl]methanone
Chemical Structure Depiction of
{4-[3-methyl-6-(2-methylpropyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}[3-(trifluoromethyl)phenyl]methanone
{4-[3-methyl-6-(2-methylpropyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}[3-(trifluoromethyl)phenyl]methanone
Compound characteristics
| Compound ID: | V010-0544 |
| Compound Name: | {4-[3-methyl-6-(2-methylpropyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}[3-(trifluoromethyl)phenyl]methanone |
| Molecular Weight: | 522.57 |
| Molecular Formula: | C28 H29 F3 N6 O |
| Salt: | not_available |
| Smiles: | CC(C)Cc1nc(c2c(C)nn(c3ccccc3)c2n1)N1CCN(CC1)C(c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5673 |
| logD: | 5.0485 |
| logSw: | -5.8953 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.422 |
| InChI Key: | QNNSOLSVFULCBN-UHFFFAOYSA-N |