1-{4-[1-(2-chlorophenyl)-6-cyclohexyl-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-cyclohexyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}-3-methylbutan-1-one
1-{4-[1-(2-chlorophenyl)-6-cyclohexyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}-3-methylbutan-1-one
Compound characteristics
| Compound ID: | V001-4119 |
| Compound Name: | 1-{4-[1-(2-chlorophenyl)-6-cyclohexyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}-3-methylbutan-1-one |
| Molecular Weight: | 481.04 |
| Molecular Formula: | C26 H33 Cl N6 O |
| Salt: | not_available |
| Smiles: | CC(C)CC(N1CCN(CC1)c1c2cnn(c3ccccc3[Cl])c2nc(C2CCCCC2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2071 |
| logD: | 6.1022 |
| logSw: | -6.0396 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 52.442 |
| InChI Key: | RHFAYANEBLRXBJ-UHFFFAOYSA-N |