6-benzyl-4-{4-[(3-methylphenyl)methyl]-1,4-diazepan-1-yl}-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Chemical Structure Depiction of
6-benzyl-4-{4-[(3-methylphenyl)methyl]-1,4-diazepan-1-yl}-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
6-benzyl-4-{4-[(3-methylphenyl)methyl]-1,4-diazepan-1-yl}-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine
Compound characteristics
| Compound ID: | V010-1644 |
| Compound Name: | 6-benzyl-4-{4-[(3-methylphenyl)methyl]-1,4-diazepan-1-yl}-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine |
| Molecular Weight: | 488.64 |
| Molecular Formula: | C31 H32 N6 |
| Salt: | not_available |
| Smiles: | Cc1cccc(CN2CCCN(CC2)c2c3cnn(c4ccccc4)c3nc(Cc3ccccc3)n2)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.6873 |
| logD: | 6.2607 |
| logSw: | -5.789 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.213 |
| InChI Key: | KHLWYSZRKUTVDF-UHFFFAOYSA-N |