3-[3-(4-ethoxy-3-methoxyphenyl)prop-2-enoyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[3-(4-ethoxy-3-methoxyphenyl)prop-2-enoyl]-2H-1-benzopyran-2-one
3-[3-(4-ethoxy-3-methoxyphenyl)prop-2-enoyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K229-0989 |
| Compound Name: | 3-[3-(4-ethoxy-3-methoxyphenyl)prop-2-enoyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 350.37 |
| Molecular Formula: | C21 H18 O5 |
| Smiles: | CCOc1ccc(/C=C/C(C2=Cc3ccccc3OC2=O)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.6821 |
| logD: | 3.6821 |
| logSw: | -4.1131 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.976 |
| InChI Key: | ILGYOIOHGGNQLD-UHFFFAOYSA-N |