N-{[(4,6-dimethylpyrimidin-2-yl)amino][3-(trifluoromethyl)anilino]methylidene}benzamide
Chemical Structure Depiction of
N-{[(4,6-dimethylpyrimidin-2-yl)amino][3-(trifluoromethyl)anilino]methylidene}benzamide
N-{[(4,6-dimethylpyrimidin-2-yl)amino][3-(trifluoromethyl)anilino]methylidene}benzamide
Compound characteristics
| Compound ID: | 4477-1498 |
| Compound Name: | N-{[(4,6-dimethylpyrimidin-2-yl)amino][3-(trifluoromethyl)anilino]methylidene}benzamide |
| Molecular Weight: | 413.4 |
| Molecular Formula: | C21 H18 F3 N5 O |
| Smiles: | Cc1cc(C)nc(NC(\Nc2cccc(c2)C(F)(F)F)=N/C(c2ccccc2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.5247 |
| logD: | 2.7012 |
| logSw: | -4.3836 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.847 |
| InChI Key: | PKZMXMZZRAQTFC-UHFFFAOYSA-N |