[4-(6-benzyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl](4-butylphenyl)methanone
Chemical Structure Depiction of
[4-(6-benzyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl](4-butylphenyl)methanone
[4-(6-benzyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl](4-butylphenyl)methanone
Compound characteristics
| Compound ID: | V015-3067 |
| Compound Name: | [4-(6-benzyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl](4-butylphenyl)methanone |
| Molecular Weight: | 558.73 |
| Molecular Formula: | C35 H38 N6 O |
| Salt: | not_available |
| Smiles: | CCCCc1ccc(cc1)C(N1CCCN(CC1)c1c2c(C)nn(c3ccccc3)c2nc(Cc2ccccc2)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.2742 |
| logD: | 7.1724 |
| logSw: | -6.015 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.481 |
| InChI Key: | OEDXAZOFKSMZEO-UHFFFAOYSA-N |