1-{4-[6-benzyl-1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}dodecan-1-one
Chemical Structure Depiction of
1-{4-[6-benzyl-1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}dodecan-1-one
1-{4-[6-benzyl-1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}dodecan-1-one
Compound characteristics
| Compound ID: | V030-5089 |
| Compound Name: | 1-{4-[6-benzyl-1-(3-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}dodecan-1-one |
| Molecular Weight: | 587.21 |
| Molecular Formula: | C34 H43 Cl N6 O |
| Salt: | not_available |
| Smiles: | CCCCCCCCCCCC(N1CCN(CC1)c1c2cnn(c3cccc(c3)[Cl])c2nc(Cc2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 9.5407 |
| logD: | 9.5302 |
| logSw: | -6.2415 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 53.541 |
| InChI Key: | VJRTUIOBRBNETI-UHFFFAOYSA-N |