{4-[3-methyl-6-(oxan-4-yl)-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-(oxan-4-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}[3-(trifluoromethyl)phenyl]methanone
{4-[3-methyl-6-(oxan-4-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}[3-(trifluoromethyl)phenyl]methanone
Compound characteristics
| Compound ID: | V007-4501 |
| Compound Name: | {4-[3-methyl-6-(oxan-4-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}[3-(trifluoromethyl)phenyl]methanone |
| Molecular Weight: | 550.58 |
| Molecular Formula: | C29 H29 F3 N6 O2 |
| Salt: | not_available |
| Smiles: | Cc1c2c(nc(C3CCOCC3)nc2n(c2ccccc2)n1)N1CCN(CC1)C(c1cccc(c1)C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8768 |
| logD: | 4.7307 |
| logSw: | -4.9315 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 61.26 |
| InChI Key: | MNNMHISNXWRQSK-UHFFFAOYSA-N |