dimethyl 5-[3-(3,4-dimethoxyphenyl)prop-2-enamido]-3-methylthiophene-2,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 5-[3-(3,4-dimethoxyphenyl)prop-2-enamido]-3-methylthiophene-2,4-dicarboxylate
dimethyl 5-[3-(3,4-dimethoxyphenyl)prop-2-enamido]-3-methylthiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | C322-0002 |
| Compound Name: | dimethyl 5-[3-(3,4-dimethoxyphenyl)prop-2-enamido]-3-methylthiophene-2,4-dicarboxylate |
| Molecular Weight: | 419.45 |
| Molecular Formula: | C20 H21 N O7 S |
| Smiles: | Cc1c(C(=O)OC)c(NC(/C=C/c2ccc(c(c2)OC)OC)=O)sc1C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.2961 |
| logD: | 1.2968 |
| logSw: | -3.6262 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.519 |
| InChI Key: | YTZLTEYWDMGBJL-UHFFFAOYSA-N |