diethyl 5-(2-{[4-(furan-2-yl)pyrimidin-2-yl]sulfanyl}acetamido)-3-methylthiophene-2,4-dicarboxylate
Chemical Structure Depiction of
diethyl 5-(2-{[4-(furan-2-yl)pyrimidin-2-yl]sulfanyl}acetamido)-3-methylthiophene-2,4-dicarboxylate
diethyl 5-(2-{[4-(furan-2-yl)pyrimidin-2-yl]sulfanyl}acetamido)-3-methylthiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | Y502-8009 |
| Compound Name: | diethyl 5-(2-{[4-(furan-2-yl)pyrimidin-2-yl]sulfanyl}acetamido)-3-methylthiophene-2,4-dicarboxylate |
| Molecular Weight: | 475.54 |
| Molecular Formula: | C21 H21 N3 O6 S2 |
| Smiles: | CCOC(c1c(C)c(C(=O)OCC)sc1NC(CSc1nccc(c2ccco2)n1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6469 |
| logD: | 1.7988 |
| logSw: | -3.9508 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.45 |
| InChI Key: | BIJIBIWCKKZIMR-UHFFFAOYSA-N |