3-(2,4-dimethoxyanilino)-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(2,4-dimethoxyanilino)-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione
3-(2,4-dimethoxyanilino)-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | E882-0415 |
| Compound Name: | 3-(2,4-dimethoxyanilino)-4-(2,4,5-trimethylphenyl)cyclobut-3-ene-1,2-dione |
| Molecular Weight: | 351.4 |
| Molecular Formula: | C21 H21 N O4 |
| Smiles: | Cc1cc(C)c(cc1C)C1=C(C(C1=O)=O)Nc1ccc(cc1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 4.6623 |
| logD: | 4.6512 |
| logSw: | -4.5034 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.371 |
| InChI Key: | SIGZYUMPUOQKST-UHFFFAOYSA-N |