2-benzyl-4-(2-fluoro-4-methoxyphenyl)-6-{4-[(4-fluorophenyl)methyl]piperazin-1-yl}-2H-pyrazolo[3,4-d]pyrimidin-3-amine
Chemical Structure Depiction of
2-benzyl-4-(2-fluoro-4-methoxyphenyl)-6-{4-[(4-fluorophenyl)methyl]piperazin-1-yl}-2H-pyrazolo[3,4-d]pyrimidin-3-amine
2-benzyl-4-(2-fluoro-4-methoxyphenyl)-6-{4-[(4-fluorophenyl)methyl]piperazin-1-yl}-2H-pyrazolo[3,4-d]pyrimidin-3-amine
Compound characteristics
| Compound ID: | V030-0045 |
| Compound Name: | 2-benzyl-4-(2-fluoro-4-methoxyphenyl)-6-{4-[(4-fluorophenyl)methyl]piperazin-1-yl}-2H-pyrazolo[3,4-d]pyrimidin-3-amine |
| Molecular Weight: | 541.6 |
| Molecular Formula: | C30 H29 F2 N7 O |
| Salt: | not_available |
| Smiles: | COc1ccc(c(c1)F)c1c2c(nc(n1)N1CCN(CC1)Cc1ccc(cc1)F)nn(Cc1ccccc1)c2N |
| Stereo: | ACHIRAL |
| logP: | 5.4022 |
| logD: | 5.3558 |
| logSw: | -5.7266 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.769 |
| InChI Key: | VUSBJYAXESVNCI-UHFFFAOYSA-N |