N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-1-benzofuran-2-carboxamide
Chemical Structure Depiction of
N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-1-benzofuran-2-carboxamide
N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-1-benzofuran-2-carboxamide
Compound characteristics
| Compound ID: | F614-0559 |
| Compound Name: | N-{1-[1-(2,4-dimethylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]-3-methyl-1H-pyrazol-5-yl}-1-benzofuran-2-carboxamide |
| Molecular Weight: | 463.5 |
| Molecular Formula: | C26 H21 N7 O2 |
| Smiles: | Cc1ccc(c(C)c1)n1c2c(cn1)c(ncn2)n1c(cc(C)n1)NC(c1cc2ccccc2o1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8524 |
| logD: | 5.8437 |
| logSw: | -6.3345 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.733 |
| InChI Key: | UGSBQWJTCHJIJB-UHFFFAOYSA-N |