[4-(6-butyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl](2-methylphenyl)methanone
Chemical Structure Depiction of
[4-(6-butyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl](2-methylphenyl)methanone
[4-(6-butyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl](2-methylphenyl)methanone
Compound characteristics
| Compound ID: | V008-1177 |
| Compound Name: | [4-(6-butyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl](2-methylphenyl)methanone |
| Molecular Weight: | 482.63 |
| Molecular Formula: | C29 H34 N6 O |
| Salt: | not_available |
| Smiles: | CCCCc1nc(c2c(C)nn(c3ccccc3)c2n1)N1CCCN(CC1)C(c1ccccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5931 |
| logD: | 5.0473 |
| logSw: | -5.6794 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.753 |
| InChI Key: | DYAZJYRJAHUJIF-UHFFFAOYSA-N |