2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]-N-(3,5-dibromopyridin-2-yl)acetamide
Chemical Structure Depiction of
2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]-N-(3,5-dibromopyridin-2-yl)acetamide
2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]-N-(3,5-dibromopyridin-2-yl)acetamide
Compound characteristics
| Compound ID: | 8003-0426 |
| Compound Name: | 2-[(5-acetyl-3-cyano-6-methylpyridin-2-yl)sulfanyl]-N-(3,5-dibromopyridin-2-yl)acetamide |
| Molecular Weight: | 484.17 |
| Molecular Formula: | C16 H12 Br2 N4 O2 S |
| Smiles: | CC(c1cc(C#N)c(nc1C)SCC(Nc1c(cc(cn1)[Br])[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4161 |
| logD: | 3.3311 |
| logSw: | -3.7769 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.101 |
| InChI Key: | BKSBXPSQDJZCFM-UHFFFAOYSA-N |