dimethyl 2-[2-cyano-3-(4-ethoxy-3-methoxyphenyl)prop-2-enamido]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
Chemical Structure Depiction of
dimethyl 2-[2-cyano-3-(4-ethoxy-3-methoxyphenyl)prop-2-enamido]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
dimethyl 2-[2-cyano-3-(4-ethoxy-3-methoxyphenyl)prop-2-enamido]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate
Compound characteristics
| Compound ID: | 3931-1663 |
| Compound Name: | dimethyl 2-[2-cyano-3-(4-ethoxy-3-methoxyphenyl)prop-2-enamido]-5,6-dihydro-4H-cyclopenta[b]thiophene-3,4-dicarboxylate |
| Molecular Weight: | 484.53 |
| Molecular Formula: | C24 H24 N2 O7 S |
| Smiles: | CCOc1ccc(\C=C(/C#N)C(Nc2c(C(=O)OC)c3C(CCc3s2)C(=O)OC)=O)cc1OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4388 |
| logD: | -0.9752 |
| logSw: | -3.9796 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.655 |
| InChI Key: | NPACDYJVJINSSN-HNNXBMFYSA-N |