N-(2-chloro-4-fluorophenyl)-1-ethyl[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
Chemical Structure Depiction of
N-(2-chloro-4-fluorophenyl)-1-ethyl[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
N-(2-chloro-4-fluorophenyl)-1-ethyl[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
Compound characteristics
Compound ID: | C301-4775 |
Compound Name: | N-(2-chloro-4-fluorophenyl)-1-ethyl[1,2,4]triazolo[4,3-a]quinoxalin-4-amine |
Molecular Weight: | 341.77 |
Molecular Formula: | C17 H13 Cl F N5 |
Smiles: | CCc1nnc2c(Nc3ccc(cc3[Cl])F)nc3ccccc3n12 |
Stereo: | ACHIRAL |
logP: | 4.2316 |
logD: | 4.2215 |
logSw: | -4.249 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 39.751 |
InChI Key: | GRNTZZKUFLASOT-UHFFFAOYSA-N |