N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-(3-methylphenyl)acetamide
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-(3-methylphenyl)acetamide
N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-(3-methylphenyl)acetamide
Compound characteristics
| Compound ID: | F614-0552 |
| Compound Name: | N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-2-(3-methylphenyl)acetamide |
| Molecular Weight: | 451.53 |
| Molecular Formula: | C26 H25 N7 O |
| Smiles: | Cc1cccc(CC(Nc2cc(C)nn2c2c3cnn(c4ccc(C)cc4C)c3ncn2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.3103 |
| logD: | 5.3079 |
| logSw: | -5.3381 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.227 |
| InChI Key: | MBNUGJLJKOBFQI-UHFFFAOYSA-N |