dimethyl 5-[3-(2H-1,3-benzodioxol-5-yl)prop-2-enamido]benzene-1,3-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-[3-(2H-1,3-benzodioxol-5-yl)prop-2-enamido]benzene-1,3-dicarboxylate
dimethyl 5-[3-(2H-1,3-benzodioxol-5-yl)prop-2-enamido]benzene-1,3-dicarboxylate
Compound characteristics
| Compound ID: | Y032-0914 |
| Compound Name: | dimethyl 5-[3-(2H-1,3-benzodioxol-5-yl)prop-2-enamido]benzene-1,3-dicarboxylate |
| Molecular Weight: | 383.36 |
| Molecular Formula: | C20 H17 N O7 |
| Smiles: | COC(c1cc(cc(c1)NC(/C=C/c1ccc2c(c1)OCO2)=O)C(=O)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1911 |
| logD: | 4.1911 |
| logSw: | -4.4242 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.579 |
| InChI Key: | OUZAMIUVWNIIQH-UHFFFAOYSA-N |