2-{[5-(but-2-en-1-yl)-3-cyano-4,6-dimethylpyridin-2-yl]sulfanyl}-N-(3,5-dibromophenyl)acetamide
Chemical Structure Depiction of
2-{[5-(but-2-en-1-yl)-3-cyano-4,6-dimethylpyridin-2-yl]sulfanyl}-N-(3,5-dibromophenyl)acetamide
2-{[5-(but-2-en-1-yl)-3-cyano-4,6-dimethylpyridin-2-yl]sulfanyl}-N-(3,5-dibromophenyl)acetamide
Compound characteristics
| Compound ID: | 8013-1338 |
| Compound Name: | 2-{[5-(but-2-en-1-yl)-3-cyano-4,6-dimethylpyridin-2-yl]sulfanyl}-N-(3,5-dibromophenyl)acetamide |
| Molecular Weight: | 509.26 |
| Molecular Formula: | C20 H19 Br2 N3 O S |
| Smiles: | C\C=C/Cc1c(C)c(C#N)c(nc1C)SCC(Nc1cc(cc(c1)[Br])[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 6.674 |
| logD: | 6.6629 |
| logSw: | -5.6592 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.497 |
| InChI Key: | ZIBHYKQYXYJQCC-UHFFFAOYSA-N |