[4-(6-butyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl](3-methoxyphenyl)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](3-methoxyphenyl)methanone
[4-(6-butyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl](3-methoxyphenyl)methanone
Compound characteristics
| Compound ID: | V018-7819 |
| Compound Name: | [4-(6-butyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl](3-methoxyphenyl)methanone |
| Molecular Weight: | 498.63 |
| Molecular Formula: | C29 H34 N6 O2 |
| Salt: | not_available |
| Smiles: | CCCCc1nc(c2c(C)nn(c3ccccc3)c2n1)N1CCCN(CC1)C(c1cccc(c1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1806 |
| logD: | 4.6349 |
| logSw: | -5.2007 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 62.297 |
| InChI Key: | HDDFVRAIQHMNLK-UHFFFAOYSA-N |