{4-[6-cyclopropyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(phenyl)methanone
Chemical Structure Depiction of
{4-[6-cyclopropyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(phenyl)methanone
{4-[6-cyclopropyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(phenyl)methanone
Compound characteristics
| Compound ID: | V024-7163 |
| Compound Name: | {4-[6-cyclopropyl-3-methyl-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(phenyl)methanone |
| Molecular Weight: | 466.59 |
| Molecular Formula: | C28 H30 N6 O |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1)n1c2c(c(C)n1)c(nc(C1CC1)n2)N1CCCN(CC1)C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0088 |
| logD: | 3.3718 |
| logSw: | -4.8841 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.014 |
| InChI Key: | MOPNTTKDJCIEPX-UHFFFAOYSA-N |