1-{4-[6-cyclopropyl-1-(4-methoxyphenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}ethan-1-one
Chemical Structure Depiction of
1-{4-[6-cyclopropyl-1-(4-methoxyphenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}ethan-1-one
1-{4-[6-cyclopropyl-1-(4-methoxyphenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | V024-7724 |
| Compound Name: | 1-{4-[6-cyclopropyl-1-(4-methoxyphenyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}ethan-1-one |
| Molecular Weight: | 420.51 |
| Molecular Formula: | C23 H28 N6 O2 |
| Salt: | not_available |
| Smiles: | CC(N1CCCN(CC1)c1c2c(C)nn(c3ccc(cc3)OC)c2nc(C2CC2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5238 |
| logD: | 1.8868 |
| logSw: | -3.7717 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 62.297 |
| InChI Key: | NIWGEDJLNXJOBE-UHFFFAOYSA-N |