3-chloro-2,2-dimethyl-1-{4-[6-(pentan-2-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}propan-1-one
Chemical Structure Depiction of
3-chloro-2,2-dimethyl-1-{4-[6-(pentan-2-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}propan-1-one
3-chloro-2,2-dimethyl-1-{4-[6-(pentan-2-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}propan-1-one
Compound characteristics
| Compound ID: | V005-4302 |
| Compound Name: | 3-chloro-2,2-dimethyl-1-{4-[6-(pentan-2-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]piperazin-1-yl}propan-1-one |
| Molecular Weight: | 469.03 |
| Molecular Formula: | C25 H33 Cl N6 O |
| Salt: | not_available |
| Smiles: | CCCC(C)c1nc(c2cnn(c3ccccc3)c2n1)N1CCN(CC1)C(C(C)(C)C[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9553 |
| logD: | 5.8437 |
| logSw: | -5.6251 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 53.35 |
| InChI Key: | AXXSYPIIWJAQMR-SFHVURJKSA-N |