1-[4-(2-fluorophenyl)piperazin-1-yl]-2-[(1-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-[4-(2-fluorophenyl)piperazin-1-yl]-2-[(1-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]ethan-1-one
1-[4-(2-fluorophenyl)piperazin-1-yl]-2-[(1-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | F989-0230 |
| Compound Name: | 1-[4-(2-fluorophenyl)piperazin-1-yl]-2-[(1-methyl[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 436.51 |
| Molecular Formula: | C22 H21 F N6 O S |
| Smiles: | Cc1nnc2c(nc3ccccc3n12)SCC(N1CCN(CC1)c1ccccc1F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9013 |
| logD: | 2.9012 |
| logSw: | -3.2209 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.909 |
| InChI Key: | BHLVXROEDAXDTF-UHFFFAOYSA-N |