3-[4-chloro-3-(trifluoromethyl)anilino]-4-phenylcyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-[4-chloro-3-(trifluoromethyl)anilino]-4-phenylcyclobut-3-ene-1,2-dione
3-[4-chloro-3-(trifluoromethyl)anilino]-4-phenylcyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E470-0285 |
| Compound Name: | 3-[4-chloro-3-(trifluoromethyl)anilino]-4-phenylcyclobut-3-ene-1,2-dione |
| Molecular Weight: | 351.71 |
| Molecular Formula: | C17 H9 Cl F3 N O2 |
| Smiles: | c1ccc(cc1)C1=C(C(C1=O)=O)Nc1ccc(c(c1)C(F)(F)F)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.685 |
| logD: | 3.6193 |
| logSw: | -5.1103 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.894 |
| InChI Key: | ZXHLRUSHWOPEJY-UHFFFAOYSA-N |