3-(4-chlorophenyl)-4-(3,4,5-trimethoxyanilino)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(4-chlorophenyl)-4-(3,4,5-trimethoxyanilino)cyclobut-3-ene-1,2-dione
3-(4-chlorophenyl)-4-(3,4,5-trimethoxyanilino)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E786-0085 |
| Compound Name: | 3-(4-chlorophenyl)-4-(3,4,5-trimethoxyanilino)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 373.79 |
| Molecular Formula: | C19 H16 Cl N O5 |
| Smiles: | COc1cc(cc(c1OC)OC)NC1=C(C(C1=O)=O)c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.1581 |
| logD: | 3.106 |
| logSw: | -3.6092 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.872 |
| InChI Key: | AVHMBFLOMDXWSO-UHFFFAOYSA-N |