N-[3-methyl-1-(1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1H-pyrazol-5-yl]-4-(trifluoromethyl)benzamide
Chemical Structure Depiction of
N-[3-methyl-1-(1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1H-pyrazol-5-yl]-4-(trifluoromethyl)benzamide
N-[3-methyl-1-(1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1H-pyrazol-5-yl]-4-(trifluoromethyl)benzamide
Compound characteristics
| Compound ID: | F614-0053 |
| Compound Name: | N-[3-methyl-1-(1-phenyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1H-pyrazol-5-yl]-4-(trifluoromethyl)benzamide |
| Molecular Weight: | 463.42 |
| Molecular Formula: | C23 H16 F3 N7 O |
| Smiles: | Cc1cc(NC(c2ccc(cc2)C(F)(F)F)=O)n(c2c3cnn(c4ccccc4)c3ncn2)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.5483 |
| logD: | 4.5292 |
| logSw: | -4.1692 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.741 |
| InChI Key: | HAFNNALCTRFXQC-UHFFFAOYSA-N |