N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(1-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(1-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(1-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | F989-0180 |
| Compound Name: | N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[(1-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]acetamide |
| Molecular Weight: | 451.86 |
| Molecular Formula: | C19 H13 Cl F3 N5 O S |
| Smiles: | Cc1nnc2c(nc3ccccc3n12)SCC(Nc1ccc(c(c1)C(F)(F)F)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.4318 |
| logD: | 4.3997 |
| logSw: | -4.6077 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.707 |
| InChI Key: | CTOYSGIWAYIVCH-UHFFFAOYSA-N |