3-(3,4-dimethoxyanilino)-4-ethoxycyclobut-3-ene-1,2-dione
Chemical Structure Depiction of
3-(3,4-dimethoxyanilino)-4-ethoxycyclobut-3-ene-1,2-dione
3-(3,4-dimethoxyanilino)-4-ethoxycyclobut-3-ene-1,2-dione
Compound characteristics
| Compound ID: | G317-0006 |
| Compound Name: | 3-(3,4-dimethoxyanilino)-4-ethoxycyclobut-3-ene-1,2-dione |
| Molecular Weight: | 277.27 |
| Molecular Formula: | C14 H15 N O5 |
| Smiles: | CCOC1=C(C(C1=O)=O)Nc1ccc(c(c1)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 1.5974 |
| logD: | 1.5621 |
| logSw: | -2.2318 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.868 |
| InChI Key: | BWFHRHGUUUVVPL-UHFFFAOYSA-N |