diethyl 5-(2-{[5,6-di(furan-2-yl)-1,2,4-triazin-3-yl]sulfanyl}acetamido)-3-methylthiophene-2,4-dicarboxylate
Chemical Structure Depiction of
diethyl 5-(2-{[5,6-di(furan-2-yl)-1,2,4-triazin-3-yl]sulfanyl}acetamido)-3-methylthiophene-2,4-dicarboxylate
diethyl 5-(2-{[5,6-di(furan-2-yl)-1,2,4-triazin-3-yl]sulfanyl}acetamido)-3-methylthiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | 8013-8047 |
| Compound Name: | diethyl 5-(2-{[5,6-di(furan-2-yl)-1,2,4-triazin-3-yl]sulfanyl}acetamido)-3-methylthiophene-2,4-dicarboxylate |
| Molecular Weight: | 542.59 |
| Molecular Formula: | C24 H22 N4 O7 S2 |
| Smiles: | CCOC(c1c(C)c(C(=O)OCC)sc1NC(CSc1nc(c(c2ccco2)nn1)c1ccco1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6919 |
| logD: | 1.8173 |
| logSw: | -4.0152 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 112.993 |
| InChI Key: | LLFORPALGRNWBN-UHFFFAOYSA-N |