3-(2,3-dimethylanilino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(2,3-dimethylanilino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
3-(2,3-dimethylanilino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E470-0058 |
| Compound Name: | 3-(2,3-dimethylanilino)-4-(4-methylphenyl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 291.35 |
| Molecular Formula: | C19 H17 N O2 |
| Smiles: | Cc1ccc(cc1)C1=C(C(C1=O)=O)Nc1cccc(C)c1C |
| Stereo: | ACHIRAL |
| logP: | 4.5601 |
| logD: | 4.5598 |
| logSw: | -4.3281 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 35.197 |
| InChI Key: | ZDKJOXZTDGVRLU-UHFFFAOYSA-N |