ethyl 5-phenyl-2-{2-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]acetamido}thiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 5-phenyl-2-{2-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]acetamido}thiophene-3-carboxylate
ethyl 5-phenyl-2-{2-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]acetamido}thiophene-3-carboxylate
Compound characteristics
| Compound ID: | 4112-4211 |
| Compound Name: | ethyl 5-phenyl-2-{2-[([1,2,4]triazolo[4,3-a]pyridin-3-yl)sulfanyl]acetamido}thiophene-3-carboxylate |
| Molecular Weight: | 438.53 |
| Molecular Formula: | C21 H18 N4 O3 S2 |
| Smiles: | CCOC(c1cc(c2ccccc2)sc1NC(CSc1nnc2ccccn12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9443 |
| logD: | 3.9335 |
| logSw: | -3.9345 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.585 |
| InChI Key: | SETKBGFWJBFXJV-UHFFFAOYSA-N |