{4-[1-(4-fluorophenyl)-3-methyl-6-(3-methylbutyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}[(2RS)-2-phenylcyclopropyl]methanone
Chemical Structure Depiction of
{4-[1-(4-fluorophenyl)-3-methyl-6-(3-methylbutyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}[(2RS)-2-phenylcyclopropyl]methanone
{4-[1-(4-fluorophenyl)-3-methyl-6-(3-methylbutyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}[(2RS)-2-phenylcyclopropyl]methanone
Compound characteristics
| Compound ID: | V008-8978 |
| Compound Name: | {4-[1-(4-fluorophenyl)-3-methyl-6-(3-methylbutyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}[(2RS)-2-phenylcyclopropyl]methanone |
| Molecular Weight: | 540.68 |
| Molecular Formula: | C32 H37 F N6 O |
| Salt: | not_available |
| Smiles: | CC(C)CCc1nc(c2c(C)nn(c3ccc(cc3)F)c2n1)N1CCCN(CC1)C(C1C[C@H]1c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.5579 |
| logD: | 5.8997 |
| logSw: | -5.9264 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 55.004 |
| InChI Key: | JCLUIAIPIWYOGV-QBHOUYDASA-N |