3-(2-ethoxyanilino)-4-[4-(propan-2-yl)phenyl]cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(2-ethoxyanilino)-4-[4-(propan-2-yl)phenyl]cyclobut-3-ene-1,2-dione
3-(2-ethoxyanilino)-4-[4-(propan-2-yl)phenyl]cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E511-0891 |
| Compound Name: | 3-(2-ethoxyanilino)-4-[4-(propan-2-yl)phenyl]cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 335.4 |
| Molecular Formula: | C21 H21 N O3 |
| Smiles: | CCOc1ccccc1NC1=C(C(C1=O)=O)c1ccc(cc1)C(C)C |
| Stereo: | ACHIRAL |
| logP: | 5.019 |
| logD: | 5.0114 |
| logSw: | -4.5143 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.407 |
| InChI Key: | LOPJSZODPSUMPK-UHFFFAOYSA-N |