N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
Compound characteristics
| Compound ID: | K405-2821 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-(4-methylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine |
| Molecular Weight: | 359.39 |
| Molecular Formula: | C20 H17 N5 O2 |
| Smiles: | Cc1ccc(cc1)n1c2c(cn1)c(NCc1ccc3c(c1)OCO3)ncn2 |
| Stereo: | ACHIRAL |
| logP: | 3.975 |
| logD: | 3.9745 |
| logSw: | -3.8766 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.465 |
| InChI Key: | QSIAALKPSSFICJ-UHFFFAOYSA-N |