ethyl 2-cyano-3-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl]prop-2-enoate
Chemical Structure Depiction of
ethyl 2-cyano-3-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl]prop-2-enoate
ethyl 2-cyano-3-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl]prop-2-enoate
Compound characteristics
| Compound ID: | 3621-0032 |
| Compound Name: | ethyl 2-cyano-3-[4-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)phenyl]prop-2-enoate |
| Molecular Weight: | 346.34 |
| Molecular Formula: | C20 H14 N2 O4 |
| Smiles: | CCOC(C(=C/c1ccc(cc1)N1C(c2ccccc2C1=O)=O)\C#N)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2413 |
| logD: | 3.2413 |
| logSw: | -3.478 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 66.69 |
| InChI Key: | XXNZKYNQRMMBCS-UHFFFAOYSA-N |