1-[4-(6-benzyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]-2,2-dimethylpropan-1-one
Chemical Structure Depiction of
1-[4-(6-benzyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]-2,2-dimethylpropan-1-one
1-[4-(6-benzyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]-2,2-dimethylpropan-1-one
Compound characteristics
| Compound ID: | V018-9721 |
| Compound Name: | 1-[4-(6-benzyl-3-methyl-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1,4-diazepan-1-yl]-2,2-dimethylpropan-1-one |
| Molecular Weight: | 482.63 |
| Molecular Formula: | C29 H34 N6 O |
| Salt: | not_available |
| Smiles: | Cc1c2c(nc(Cc3ccccc3)nc2n(c2ccccc2)n1)N1CCCN(CC1)C(C(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.36 |
| logD: | 5.2583 |
| logSw: | -5.4088 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.753 |
| InChI Key: | FSYYZPLAYIAUOM-UHFFFAOYSA-N |