8-ethoxy-3-[3-(4-methylphenyl)prop-2-enoyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
8-ethoxy-3-[3-(4-methylphenyl)prop-2-enoyl]-2H-1-benzopyran-2-one
8-ethoxy-3-[3-(4-methylphenyl)prop-2-enoyl]-2H-1-benzopyran-2-one
Compound characteristics
Compound ID: | K229-1000 |
Compound Name: | 8-ethoxy-3-[3-(4-methylphenyl)prop-2-enoyl]-2H-1-benzopyran-2-one |
Molecular Weight: | 334.37 |
Molecular Formula: | C21 H18 O4 |
Smiles: | CCOc1cccc2C=C(C(/C=C/c3ccc(C)cc3)=O)C(=O)Oc12 |
Stereo: | ACHIRAL |
logP: | 4.5202 |
logD: | 4.5202 |
logSw: | -4.5435 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 41.03 |
InChI Key: | AMOQKODGYFUOIT-UHFFFAOYSA-N |