diethyl 3-methyl-5-{3-[4-(propan-2-yl)phenyl]prop-2-enamido}thiophene-2,4-dicarboxylate
Chemical Structure Depiction of
diethyl 3-methyl-5-{3-[4-(propan-2-yl)phenyl]prop-2-enamido}thiophene-2,4-dicarboxylate
diethyl 3-methyl-5-{3-[4-(propan-2-yl)phenyl]prop-2-enamido}thiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | 1889-2883 |
| Compound Name: | diethyl 3-methyl-5-{3-[4-(propan-2-yl)phenyl]prop-2-enamido}thiophene-2,4-dicarboxylate |
| Molecular Weight: | 429.53 |
| Molecular Formula: | C23 H27 N O5 S |
| Smiles: | CCOC(c1c(C)c(C(=O)OCC)sc1NC(/C=C/c1ccc(cc1)C(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7303 |
| logD: | 3.731 |
| logSw: | -5.6227 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.418 |
| InChI Key: | TXJJABLJVCWAQY-UHFFFAOYSA-N |