3-(3,4-dimethylphenyl)-4-[2-(trifluoromethyl)anilino]cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(3,4-dimethylphenyl)-4-[2-(trifluoromethyl)anilino]cyclobut-3-ene-1,2-dione
3-(3,4-dimethylphenyl)-4-[2-(trifluoromethyl)anilino]cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E470-0539 |
| Compound Name: | 3-(3,4-dimethylphenyl)-4-[2-(trifluoromethyl)anilino]cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 345.32 |
| Molecular Formula: | C19 H14 F3 N O2 |
| Smiles: | Cc1ccc(cc1C)C1=C(C(C1=O)=O)Nc1ccccc1C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 4.9871 |
| logD: | 4.987 |
| logSw: | -4.5789 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.197 |
| InChI Key: | QWLDQGHDQVKBQX-UHFFFAOYSA-N |