3-(2H-1,3-benzodioxol-5-yl)-N-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxo-1-phenylethyl}-N-methylprop-2-enamide
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-N-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxo-1-phenylethyl}-N-methylprop-2-enamide
3-(2H-1,3-benzodioxol-5-yl)-N-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxo-1-phenylethyl}-N-methylprop-2-enamide
Compound characteristics
| Compound ID: | C094-0235 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-N-{2-[(2H-1,3-benzodioxol-5-yl)amino]-2-oxo-1-phenylethyl}-N-methylprop-2-enamide |
| Molecular Weight: | 458.47 |
| Molecular Formula: | C26 H22 N2 O6 |
| Smiles: | CN(C(C(Nc1ccc2c(c1)OCO2)=O)c1ccccc1)C(/C=C\c1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2115 |
| logD: | 4.2113 |
| logSw: | -4.3449 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.975 |
| InChI Key: | ZJXKVBRFOHOZKZ-RUZDIDTESA-N |