3-(3-fluoroanilino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(3-fluoroanilino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
3-(3-fluoroanilino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E470-0071 |
| Compound Name: | 3-(3-fluoroanilino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 281.28 |
| Molecular Formula: | C17 H12 F N O2 |
| Smiles: | Cc1ccc(cc1)C1=C(C(C1=O)=O)Nc1cccc(c1)F |
| Stereo: | ACHIRAL |
| logP: | 3.7596 |
| logD: | 3.7382 |
| logSw: | -3.8772 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.894 |
| InChI Key: | VELXTMQTAHORGE-UHFFFAOYSA-N |