(3-nitrophenyl){4-[6-(oxan-4-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}methanone
Chemical Structure Depiction of
(3-nitrophenyl){4-[6-(oxan-4-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}methanone
(3-nitrophenyl){4-[6-(oxan-4-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}methanone
Compound characteristics
| Compound ID: | V008-8681 |
| Compound Name: | (3-nitrophenyl){4-[6-(oxan-4-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}methanone |
| Molecular Weight: | 513.56 |
| Molecular Formula: | C27 H27 N7 O4 |
| Salt: | not_available |
| Smiles: | C1COCCC1c1nc(c2cnn(c3ccccc3)c2n1)N1CCN(CC1)C(c1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.224 |
| logD: | 4.2083 |
| logSw: | -4.2292 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 94.289 |
| InChI Key: | SGSKAMNNNYLMGA-UHFFFAOYSA-N |