N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-ethoxybenzamide
Chemical Structure Depiction of
N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-ethoxybenzamide
N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-ethoxybenzamide
Compound characteristics
| Compound ID: | F614-0507 |
| Compound Name: | N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-ethoxybenzamide |
| Molecular Weight: | 467.53 |
| Molecular Formula: | C26 H25 N7 O2 |
| Smiles: | CCOc1ccccc1C(Nc1cc(C)nn1c1c2cnn(c3ccc(C)cc3C)c2ncn1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.176 |
| logD: | 4.9505 |
| logSw: | -4.864 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.65 |
| InChI Key: | ZRUJJTDQTUNKJR-UHFFFAOYSA-N |