8-fluoro-4-hydroxy-N-[(1S)-3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]quinoline-3-carboxamide
Chemical Structure Depiction of
8-fluoro-4-hydroxy-N-[(1S)-3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]quinoline-3-carboxamide
8-fluoro-4-hydroxy-N-[(1S)-3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]quinoline-3-carboxamide
Compound characteristics
| Compound ID: | Y043-5258 |
| Compound Name: | 8-fluoro-4-hydroxy-N-[(1S)-3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]quinoline-3-carboxamide |
| Molecular Weight: | 411.46 |
| Molecular Formula: | C20 H18 F N5 O2 S |
| Smiles: | CSCC[C@@H](c1nnc2ccccn12)NC(c1cnc2c(cccc2c1O)F)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.4787 |
| logD: | 2.4294 |
| logSw: | -2.7443 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.994 |
| InChI Key: | PBPSMMDOWUXIFV-HNNXBMFYSA-N |