(2-chlorophenyl)[4-(6-cyclopropyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]methanone
Chemical Structure Depiction of
(2-chlorophenyl)[4-(6-cyclopropyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]methanone
(2-chlorophenyl)[4-(6-cyclopropyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]methanone
Compound characteristics
| Compound ID: | V027-8249 |
| Compound Name: | (2-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(c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.1876 |
| logD: | 4.4969 |
| logSw: | -5.4637 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 53.661 |
| InChI Key: | SMUQQBSHUTVHON-UHFFFAOYSA-N |