(3,5-dimethoxyphenyl)[4-(1-phenyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]methanone
Chemical Structure Depiction of
(3,5-dimethoxyphenyl)[4-(1-phenyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]methanone
(3,5-dimethoxyphenyl)[4-(1-phenyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]methanone
Compound characteristics
| Compound ID: | V019-6397 |
| Compound Name: | (3,5-dimethoxyphenyl)[4-(1-phenyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]methanone |
| Molecular Weight: | 500.6 |
| Molecular Formula: | C28 H32 N6 O3 |
| Salt: | not_available |
| Smiles: | CCCc1nc(c2cnn(c3ccccc3)c2n1)N1CCCN(CC1)C(c1cc(cc(c1)OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2178 |
| logD: | 5.1518 |
| logSw: | -5.0626 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 69.487 |
| InChI Key: | BCOQKSGCAGKPLG-UHFFFAOYSA-N |