2-{[6-(2-acetamidophenyl)-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl]sulfanyl}-N-(2,3,5,6-tetrafluorophenyl)butanamide
Chemical Structure Depiction of
2-{[6-(2-acetamidophenyl)-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl]sulfanyl}-N-(2,3,5,6-tetrafluorophenyl)butanamide
2-{[6-(2-acetamidophenyl)-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl]sulfanyl}-N-(2,3,5,6-tetrafluorophenyl)butanamide
Compound characteristics
| Compound ID: | F151-0287 |
| Compound Name: | 2-{[6-(2-acetamidophenyl)-5-oxo-4,5-dihydro-1,2,4-triazin-3-yl]sulfanyl}-N-(2,3,5,6-tetrafluorophenyl)butanamide |
| Molecular Weight: | 495.45 |
| Molecular Formula: | C21 H17 F4 N5 O3 S |
| Smiles: | CCC(C(Nc1c(c(cc(c1F)F)F)F)=O)SC1NC(C(c2ccccc2NC(C)=O)=NN=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2677 |
| logD: | 0.8191 |
| logSw: | -3.6416 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 89.327 |
| InChI Key: | QZNOUCMSJIDSTG-AWEZNQCLSA-N |