(adamantan-1-yl)[4-(6-benzyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]methanone
Chemical Structure Depiction of
(adamantan-1-yl)[4-(6-benzyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]methanone
(adamantan-1-yl)[4-(6-benzyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]methanone
Compound characteristics
| Compound ID: | V011-1629 |
| Compound Name: | (adamantan-1-yl)[4-(6-benzyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]methanone |
| Molecular Weight: | 546.72 |
| Molecular Formula: | C34 H38 N6 O |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)c1c2cnn(c3ccccc3)c2nc(Cc2ccccc2)n1)C(C12CC3CC(CC(C3)C2)C1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.4019 |
| logD: | 7.3915 |
| logSw: | -6.0148 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.161 |
| InChI Key: | BSAAVRVXKYZXPK-UHFFFAOYSA-N |