2-(benzyloxy)-1-{4-[6-(oxan-4-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(benzyloxy)-1-{4-[6-(oxan-4-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}ethan-1-one
2-(benzyloxy)-1-{4-[6-(oxan-4-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | V020-2575 |
| Compound Name: | 2-(benzyloxy)-1-{4-[6-(oxan-4-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}ethan-1-one |
| Molecular Weight: | 526.64 |
| Molecular Formula: | C30 H34 N6 O3 |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)c1c2cnn(c3ccccc3)c2nc(C2CCOCC2)n1)C(COCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.459 |
| logD: | 4.4433 |
| logSw: | -4.2309 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 69.145 |
| InChI Key: | YNOFSBPMKVNHTO-UHFFFAOYSA-N |