N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | F989-0053 |
| Compound Name: | N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[([1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 437.83 |
| Molecular Formula: | C18 H11 Cl F3 N5 O S |
| Smiles: | C(C(Nc1cc(ccc1[Cl])C(F)(F)F)=O)Sc1c2nncn2c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 3.9391 |
| logD: | 3.9002 |
| logSw: | -4.4398 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.838 |
| InChI Key: | FBAAUNPHAISQJC-UHFFFAOYSA-N |