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| Duplicate ID | |
|---|---|
| Molecule Name | 6-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine |
| Smiles | COc1ccccc1N1CCN(CC1)c1nc(Nc2ccc(cc2)C)c2c(n1)[nH]nc2 |
| Cas Number | 1105223-97-9 |
| InchiKey | REIWMKDAAVEZPR-UHFFFAOYSA-N |
| InChi | InChI=1S/C23H25N7O/c1-16-7-9-17(10-8-16)25-21-18-15-24-28-22(18)27-23(26-21)30-13-11-29(12-14-30)19-5-3-4-6-20(19)31-2/h3-10,15H,11-14H2,1-2H3,(H2,24,25,26,27,28) |
| Formula | C23H25N7O |
| Molecular weight | 415.491 |
| Rings | 5 |
| logP | 3.9431 |
| PSA | 82.2 |
| MR | 129.183 |