3-(3,4-dimethoxyanilino)-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(3,4-dimethoxyanilino)-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione
3-(3,4-dimethoxyanilino)-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E470-0803 |
| Compound Name: | 3-(3,4-dimethoxyanilino)-4-(4-methoxyphenyl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 339.35 |
| Molecular Formula: | C19 H17 N O5 |
| Smiles: | COc1ccc(cc1)C1=C(C(C1=O)=O)Nc1ccc(c(c1)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.7001 |
| logD: | 2.6943 |
| logSw: | -3.3184 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.699 |
| InChI Key: | PBSVSZVWQQMZTJ-UHFFFAOYSA-N |