1-[4-(3,6-dimethyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]ethan-1-one
Chemical Structure Depiction of
1-[4-(3,6-dimethyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]ethan-1-one
1-[4-(3,6-dimethyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]ethan-1-one
Compound characteristics
| Compound ID: | V025-5217 |
| Compound Name: | 1-[4-(3,6-dimethyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]ethan-1-one |
| Molecular Weight: | 364.45 |
| Molecular Formula: | C20 H24 N6 O |
| Smiles: | CC(N1CCCN(CC1)c1c2c(C)nn(c3ccccc3)c2nc(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5502 |
| logD: | 2.2307 |
| logSw: | -2.5824 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.114 |
| InChI Key: | CZQCJTRKPZDJFA-UHFFFAOYSA-N |