{4-[6-(2-methylpropyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}(3-nitrophenyl)methanone
Chemical Structure Depiction of
{4-[6-(2-methylpropyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}(3-nitrophenyl)methanone
{4-[6-(2-methylpropyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}(3-nitrophenyl)methanone
Compound characteristics
| Compound ID: | V011-1441 |
| Compound Name: | {4-[6-(2-methylpropyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}(3-nitrophenyl)methanone |
| Molecular Weight: | 485.55 |
| Molecular Formula: | C26 H27 N7 O3 |
| Salt: | not_available |
| Smiles: | CC(C)Cc1nc(c2cnn(c3ccccc3)c2n1)N1CCN(CC1)C(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9145 |
| logD: | 4.8309 |
| logSw: | -4.7183 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 87.45 |
| InChI Key: | MDVOWNBDHJMJJL-UHFFFAOYSA-N |