methyl 4-hydroxy-5-[1-hydroxy-2-(4-methoxyphenyl)-2-oxoethyl]-2-methylthiophene-3-carboxylate
Chemical Structure Depiction of
methyl 4-hydroxy-5-[1-hydroxy-2-(4-methoxyphenyl)-2-oxoethyl]-2-methylthiophene-3-carboxylate
methyl 4-hydroxy-5-[1-hydroxy-2-(4-methoxyphenyl)-2-oxoethyl]-2-methylthiophene-3-carboxylate
Compound characteristics
Compound ID: | 8018-5697 |
Compound Name: | methyl 4-hydroxy-5-[1-hydroxy-2-(4-methoxyphenyl)-2-oxoethyl]-2-methylthiophene-3-carboxylate |
Molecular Weight: | 336.36 |
Molecular Formula: | C16 H16 O6 S |
Smiles: | Cc1c(C(=O)OC)c(c(C(C(c2ccc(cc2)OC)=O)O)s1)O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.4204 |
logD: | 2.4098 |
logSw: | -2.5383 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 74.605 |
InChI Key: | BBPDYGYGENVVPR-AWEZNQCLSA-N |