1-{4-[6-(2-methylpropyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}butan-1-one
Chemical Structure Depiction of
1-{4-[6-(2-methylpropyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}butan-1-one
1-{4-[6-(2-methylpropyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}butan-1-one
Compound characteristics
| Compound ID: | V017-0937 |
| Compound Name: | 1-{4-[6-(2-methylpropyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}butan-1-one |
| Molecular Weight: | 420.56 |
| Molecular Formula: | C24 H32 N6 O |
| Salt: | not_available |
| Smiles: | CCCC(N1CCCN(CC1)c1c2cnn(c3ccccc3)c2nc(CC(C)C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0325 |
| logD: | 4.9489 |
| logSw: | -4.4784 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.144 |
| InChI Key: | UTQKCBLGZLIZQW-UHFFFAOYSA-N |