{4-[6-(butan-2-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(3-methoxyphenyl)methanone
Chemical Structure Depiction of
{4-[6-(butan-2-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(3-methoxyphenyl)methanone
{4-[6-(butan-2-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(3-methoxyphenyl)methanone
Compound characteristics
| Compound ID: | V027-6379 |
| Compound Name: | {4-[6-(butan-2-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}(3-methoxyphenyl)methanone |
| Molecular Weight: | 484.6 |
| Molecular Formula: | C28 H32 N6 O2 |
| Salt: | not_available |
| Smiles: | CCC(C)c1nc(c2cnn(c3ccccc3)c2n1)N1CCCN(CC1)C(c1cccc(c1)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3861 |
| logD: | 5.3043 |
| logSw: | -5.3765 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 60.953 |
| InChI Key: | WBZGREQSLKRILG-FQEVSTJZSA-N |