2-(benzyloxy)-1-[4-(6-benzyl-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-benzyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]ethan-1-one
2-(benzyloxy)-1-[4-(6-benzyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | V011-5102 |
| Compound Name: | 2-(benzyloxy)-1-[4-(6-benzyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]ethan-1-one |
| Molecular Weight: | 532.65 |
| Molecular Formula: | C32 H32 N6 O2 |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)c1c2cnn(c3ccccc3)c2nc(Cc2ccccc2)n1)C(COCc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3383 |
| logD: | 5.3278 |
| logSw: | -5.4658 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 62.035 |
| InChI Key: | ABMPWRQATWGZBB-UHFFFAOYSA-N |