N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-4-[(propan-2-yl)oxy]benzamide
Chemical Structure Depiction of
N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-4-[(propan-2-yl)oxy]benzamide
N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-4-[(propan-2-yl)oxy]benzamide
Compound characteristics
| Compound ID: | F614-0509 |
| Compound Name: | N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-4-[(propan-2-yl)oxy]benzamide |
| Molecular Weight: | 481.56 |
| Molecular Formula: | C27 H27 N7 O2 |
| Smiles: | CC(C)Oc1ccc(cc1)C(Nc1cc(C)nn1c1c2cnn(c3ccc(C)cc3C)c2ncn1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5636 |
| logD: | 5.5558 |
| logSw: | -5.44 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.243 |
| InChI Key: | QLEXEWXGATXNQB-UHFFFAOYSA-N |