diethyl 3-methyl-5-[2-({5-[(3-methyl-1H-pyrazol-1-yl)methyl]-1,3,4-oxadiazol-2-yl}sulfanyl)acetamido]thiophene-2,4-dicarboxylate
Chemical Structure Depiction of
diethyl 3-methyl-5-[2-({5-[(3-methyl-1H-pyrazol-1-yl)methyl]-1,3,4-oxadiazol-2-yl}sulfanyl)acetamido]thiophene-2,4-dicarboxylate
diethyl 3-methyl-5-[2-({5-[(3-methyl-1H-pyrazol-1-yl)methyl]-1,3,4-oxadiazol-2-yl}sulfanyl)acetamido]thiophene-2,4-dicarboxylate
Compound characteristics
| Compound ID: | Y502-6535 |
| Compound Name: | diethyl 3-methyl-5-[2-({5-[(3-methyl-1H-pyrazol-1-yl)methyl]-1,3,4-oxadiazol-2-yl}sulfanyl)acetamido]thiophene-2,4-dicarboxylate |
| Molecular Weight: | 493.56 |
| Molecular Formula: | C20 H23 N5 O6 S2 |
| Smiles: | CCOC(c1c(C)c(C(=O)OCC)sc1NC(CSc1nnc(Cn2ccc(C)n2)o1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7109 |
| logD: | -0.1636 |
| logSw: | -2.563 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 108.647 |
| InChI Key: | SORRWKUZEVXMQZ-UHFFFAOYSA-N |