1-{4-[1-(2-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}-3-methylbutan-1-one
Chemical Structure Depiction of
1-{4-[1-(2-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}-3-methylbutan-1-one
1-{4-[1-(2-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}-3-methylbutan-1-one
Compound characteristics
| Compound ID: | V025-0680 |
| Compound Name: | 1-{4-[1-(2-chlorophenyl)-6-(propan-2-yl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}-3-methylbutan-1-one |
| Molecular Weight: | 440.98 |
| Molecular Formula: | C23 H29 Cl N6 O |
| Salt: | not_available |
| Smiles: | CC(C)CC(N1CCN(CC1)c1c2cnn(c3ccccc3[Cl])c2nc(C(C)C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1027 |
| logD: | 5.0381 |
| logSw: | -5.3676 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 52.521 |
| InChI Key: | LKYMWYBWKPERDL-UHFFFAOYSA-N |