1-[4-(6-ethyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]propan-1-one
Chemical Structure Depiction of
1-[4-(6-ethyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]propan-1-one
1-[4-(6-ethyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]propan-1-one
Compound characteristics
| Compound ID: | V024-5542 |
| Compound Name: | 1-[4-(6-ethyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]propan-1-one |
| Molecular Weight: | 392.5 |
| Molecular Formula: | C22 H28 N6 O |
| Smiles: | CCC(N1CCCN(CC1)c1c2c(C)nn(c3ccccc3)c2nc(CC)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4274 |
| logD: | 3.0519 |
| logSw: | -3.6611 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.497 |
| InChI Key: | GCUQITMVDHXUCK-UHFFFAOYSA-N |