3-(2,5-diethoxyanilino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(2,5-diethoxyanilino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
3-(2,5-diethoxyanilino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E470-0186 |
| Compound Name: | 3-(2,5-diethoxyanilino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 351.4 |
| Molecular Formula: | C21 H21 N O4 |
| Smiles: | CCOc1ccc(c(c1)NC1=C(C(C1=O)=O)c1ccc(C)cc1)OCC |
| Stereo: | ACHIRAL |
| logP: | 4.422 |
| logD: | 4.3541 |
| logSw: | -4.2942 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.53 |
| InChI Key: | OAXKBGWFRYRIAH-UHFFFAOYSA-N |