N-{[2-chloro-5-(trifluoromethyl)anilino][(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-2,2,2-trifluoroacetamide
Chemical Structure Depiction of
N-{[2-chloro-5-(trifluoromethyl)anilino][(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-2,2,2-trifluoroacetamide
N-{[2-chloro-5-(trifluoromethyl)anilino][(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-2,2,2-trifluoroacetamide
Compound characteristics
| Compound ID: | 3652-0046 |
| Compound Name: | N-{[2-chloro-5-(trifluoromethyl)anilino][(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-2,2,2-trifluoroacetamide |
| Molecular Weight: | 439.75 |
| Molecular Formula: | C16 H12 Cl F6 N5 O |
| Smiles: | Cc1cc(C)nc(NC(\Nc2cc(ccc2[Cl])C(F)(F)F)=N/C(C(F)(F)F)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.2899 |
| logD: | 2.7294 |
| logSw: | -4.5274 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.421 |
| InChI Key: | YVAVRBQPYZDPOM-UHFFFAOYSA-N |