2-ethyl-1-(4-{6-[(4-methylphenyl)methyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)hexan-1-one
Chemical Structure Depiction of
2-ethyl-1-(4-{6-[(4-methylphenyl)methyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)hexan-1-one
2-ethyl-1-(4-{6-[(4-methylphenyl)methyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)hexan-1-one
Compound characteristics
| Compound ID: | V012-5813 |
| Compound Name: | 2-ethyl-1-(4-{6-[(4-methylphenyl)methyl]-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl}-1,4-diazepan-1-yl)hexan-1-one |
| Molecular Weight: | 524.71 |
| Molecular Formula: | C32 H40 N6 O |
| Salt: | not_available |
| Smiles: | CCCCC(CC)C(N1CCCN(CC1)c1c2cnn(c3ccccc3)c2nc(Cc2ccc(C)cc2)n1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.4399 |
| logD: | 7.4295 |
| logSw: | -5.67 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.4 |
| InChI Key: | FSYANFFKZRUSHP-SANMLTNESA-N |