1-{4-[6-(butan-2-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}ethan-1-one
Chemical Structure Depiction of
1-{4-[6-(butan-2-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}ethan-1-one
1-{4-[6-(butan-2-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | V024-9513 |
| Compound Name: | 1-{4-[6-(butan-2-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}ethan-1-one |
| Molecular Weight: | 392.5 |
| Molecular Formula: | C22 H28 N6 O |
| Salt: | not_available |
| Smiles: | CCC(C)c1nc(c2cnn(c3ccccc3)c2n1)N1CCCN(CC1)C(C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.259 |
| logD: | 4.1771 |
| logSw: | -3.953 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.149 |
| InChI Key: | XIDSLODOKJCICA-INIZCTEOSA-N |