3-methyl-6-(2-methylpropyl)-1-phenyl-4-(4-{[4-(propan-2-yl)phenyl]methyl}-1,4-diazepan-1-yl)-1H-pyrazolo[3,4-d]pyrimidine
Chemical Structure Depiction of
3-methyl-6-(2-methylpropyl)-1-phenyl-4-(4-{[4-(propan-2-yl)phenyl]methyl}-1,4-diazepan-1-yl)-1H-pyrazolo[3,4-d]pyrimidine
3-methyl-6-(2-methylpropyl)-1-phenyl-4-(4-{[4-(propan-2-yl)phenyl]methyl}-1,4-diazepan-1-yl)-1H-pyrazolo[3,4-d]pyrimidine
Compound characteristics
| Compound ID: | V009-2015 |
| Compound Name: | 3-methyl-6-(2-methylpropyl)-1-phenyl-4-(4-{[4-(propan-2-yl)phenyl]methyl}-1,4-diazepan-1-yl)-1H-pyrazolo[3,4-d]pyrimidine |
| Molecular Weight: | 496.7 |
| Molecular Formula: | C31 H40 N6 |
| Salt: | not_available |
| Smiles: | CC(C)Cc1nc(c2c(C)nn(c3ccccc3)c2n1)N1CCCN(CC1)Cc1ccc(cc1)C(C)C |
| Stereo: | ACHIRAL |
| logP: | 6.9852 |
| logD: | 6.4019 |
| logSw: | -6.1876 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.837 |
| InChI Key: | MTDUETFIRRYIFD-UHFFFAOYSA-N |