cyclobutyl{4-[6-ethyl-3-methyl-1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone
Chemical Structure Depiction of
cyclobutyl{4-[6-ethyl-3-methyl-1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone
cyclobutyl{4-[6-ethyl-3-methyl-1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone
Compound characteristics
| Compound ID: | V024-7687 |
| Compound Name: | cyclobutyl{4-[6-ethyl-3-methyl-1-(2-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}methanone |
| Molecular Weight: | 432.57 |
| Molecular Formula: | C25 H32 N6 O |
| Salt: | not_available |
| Smiles: | CCc1nc(c2c(C)nn(c3ccccc3C)c2n1)N1CCCN(CC1)C(C1CCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0368 |
| logD: | 3.3453 |
| logSw: | -4.1953 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.975 |
| InChI Key: | QCDHPUXIBPCVGI-UHFFFAOYSA-N |