cyclopropyl(4-{3-methyl-6-[(4-methylphenyl)methyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)methanone
Chemical Structure Depiction of
cyclopropyl(4-{3-methyl-6-[(4-methylphenyl)methyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)methanone
cyclopropyl(4-{3-methyl-6-[(4-methylphenyl)methyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)methanone
Compound characteristics
| Compound ID: | V006-3022 |
| Compound Name: | cyclopropyl(4-{3-methyl-6-[(4-methylphenyl)methyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)methanone |
| Molecular Weight: | 480.61 |
| Molecular Formula: | C29 H32 N6 O |
| Salt: | not_available |
| Smiles: | Cc1ccc(Cc2nc(c3c(C)nn(c4ccccc4)c3n2)N2CCCN(CC2)C(C2CC2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1686 |
| logD: | 5.0669 |
| logSw: | -5.2053 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 55.004 |
| InChI Key: | ZLWXRYGYLQEGPG-UHFFFAOYSA-N |