{4-[1-(4-fluorophenyl)-3-methyl-6-propyl-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-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}[(2RS)-2-phenylcyclopropyl]methanone
{4-[1-(4-fluorophenyl)-3-methyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}[(2RS)-2-phenylcyclopropyl]methanone
Compound characteristics
| Compound ID: | V016-9016 |
| Compound Name: | {4-[1-(4-fluorophenyl)-3-methyl-6-propyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-1,4-diazepan-1-yl}[(2RS)-2-phenylcyclopropyl]methanone |
| Molecular Weight: | 512.63 |
| Molecular Formula: | C30 H33 F N6 O |
| Salt: | not_available |
| Smiles: | CCCc1nc(c2c(C)nn(c3ccc(cc3)F)c2n1)N1CCCN(CC1)C(C1C[C@H]1c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.8436 |
| logD: | 5.3998 |
| logSw: | -5.74 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 55.004 |
| InChI Key: | LXRAXANYJWBZBM-SKCDSABHSA-N |