1-{4-[6-(2-methylpropyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}pentan-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}pentan-1-one
1-{4-[6-(2-methylpropyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}pentan-1-one
Compound characteristics
| Compound ID: | V017-0949 |
| Compound Name: | 1-{4-[6-(2-methylpropyl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}pentan-1-one |
| Molecular Weight: | 434.58 |
| Molecular Formula: | C25 H34 N6 O |
| Salt: | not_available |
| Smiles: | CCCCC(N1CCCN(CC1)c1c2cnn(c3ccccc3)c2nc(CC(C)C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3341 |
| logD: | 5.2505 |
| logSw: | -5.2863 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.144 |
| InChI Key: | CZIIMRLOPIKVNF-UHFFFAOYSA-N |