(4-chlorophenyl)[4-(6-cyclopropyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]methanone
Chemical Structure Depiction of
(4-chlorophenyl)[4-(6-cyclopropyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]methanone
(4-chlorophenyl)[4-(6-cyclopropyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]methanone
Compound characteristics
| Compound ID: | V024-7817 |
| Compound Name: | (4-chlorophenyl)[4-(6-cyclopropyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]methanone |
| Molecular Weight: | 472.98 |
| Molecular Formula: | C26 H25 Cl N6 O |
| Salt: | not_available |
| Smiles: | C1CN(CCN(C1)c1c2cnn(c3ccccc3)c2nc(C2CC2)n1)C(c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.3684 |
| logD: | 4.6777 |
| logSw: | -6.1016 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 53.661 |
| InChI Key: | RKIKXBXMMXEEKO-UHFFFAOYSA-N |