3-[3-(2,4,5-trimethoxyphenyl)prop-2-enoyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[3-(2,4,5-trimethoxyphenyl)prop-2-enoyl]-2H-1-benzopyran-2-one
3-[3-(2,4,5-trimethoxyphenyl)prop-2-enoyl]-2H-1-benzopyran-2-one
Compound characteristics
Compound ID: | K229-0012 |
Compound Name: | 3-[3-(2,4,5-trimethoxyphenyl)prop-2-enoyl]-2H-1-benzopyran-2-one |
Molecular Weight: | 366.37 |
Molecular Formula: | C21 H18 O6 |
Smiles: | COc1cc(c(cc1/C=C/C(C1=Cc2ccccc2OC1=O)=O)OC)OC |
Stereo: | ACHIRAL |
logP: | 2.9487 |
logD: | 2.9487 |
logSw: | -3.3087 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 57.027 |
InChI Key: | JYWUMORVNVBMKT-UHFFFAOYSA-N |