3-(2H-1,3-benzodioxol-5-yl)-N-[2-(4-methoxyanilino)-2-oxo-1-phenylethyl]prop-2-enamide
Chemical Structure Depiction of
3-(2H-1,3-benzodioxol-5-yl)-N-[2-(4-methoxyanilino)-2-oxo-1-phenylethyl]prop-2-enamide
3-(2H-1,3-benzodioxol-5-yl)-N-[2-(4-methoxyanilino)-2-oxo-1-phenylethyl]prop-2-enamide
Compound characteristics
| Compound ID: | C094-0341 |
| Compound Name: | 3-(2H-1,3-benzodioxol-5-yl)-N-[2-(4-methoxyanilino)-2-oxo-1-phenylethyl]prop-2-enamide |
| Molecular Weight: | 430.46 |
| Molecular Formula: | C25 H22 N2 O5 |
| Smiles: | COc1ccc(cc1)NC(C(c1ccccc1)NC(/C=C\c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2383 |
| logD: | 4.2382 |
| logSw: | -4.4244 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.541 |
| InChI Key: | QOTUWDCDLKWCSA-XMMPIXPASA-N |