3-[4-(propan-2-yl)phenyl]-4-(3,4,5-trimethoxyanilino)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-[4-(propan-2-yl)phenyl]-4-(3,4,5-trimethoxyanilino)cyclobut-3-ene-1,2-dione
3-[4-(propan-2-yl)phenyl]-4-(3,4,5-trimethoxyanilino)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E511-0824 |
| Compound Name: | 3-[4-(propan-2-yl)phenyl]-4-(3,4,5-trimethoxyanilino)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 381.43 |
| Molecular Formula: | C22 H23 N O5 |
| Smiles: | CC(C)c1ccc(cc1)C1=C(C(C1=O)=O)Nc1cc(c(c(c1)OC)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 3.9016 |
| logD: | 3.8495 |
| logSw: | -4.1083 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.872 |
| InChI Key: | BMQKNIZNGBPDJZ-UHFFFAOYSA-N |