ethyl {3-[4-(2H-1,3-benzodioxol-5-yl)-2-oxobut-3-en-1-yl]-3-hydroxy-2-oxo-2,3-dihydro-1H-indol-1-yl}acetate
Chemical Structure Depiction of
ethyl {3-[4-(2H-1,3-benzodioxol-5-yl)-2-oxobut-3-en-1-yl]-3-hydroxy-2-oxo-2,3-dihydro-1H-indol-1-yl}acetate
ethyl {3-[4-(2H-1,3-benzodioxol-5-yl)-2-oxobut-3-en-1-yl]-3-hydroxy-2-oxo-2,3-dihydro-1H-indol-1-yl}acetate
Compound characteristics
| Compound ID: | 5241-0131 |
| Compound Name: | ethyl {3-[4-(2H-1,3-benzodioxol-5-yl)-2-oxobut-3-en-1-yl]-3-hydroxy-2-oxo-2,3-dihydro-1H-indol-1-yl}acetate |
| Molecular Weight: | 423.42 |
| Molecular Formula: | C23 H21 N O7 |
| Smiles: | CCOC(CN1C(C(CC(/C=C\c2ccc3c(c2)OCO3)=O)(c2ccccc12)O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5742 |
| logD: | 2.5742 |
| logSw: | -3.0724 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.097 |
| InChI Key: | HFEYANZCSPBNRM-QHCPKHFHSA-N |