4-(3,4-dihydroisoquinolin-2(1H)-yl)-1-ethyl[1,2,4]triazolo[4,3-a]quinoxaline
Chemical Structure Depiction of
4-(3,4-dihydroisoquinolin-2(1H)-yl)-1-ethyl[1,2,4]triazolo[4,3-a]quinoxaline
4-(3,4-dihydroisoquinolin-2(1H)-yl)-1-ethyl[1,2,4]triazolo[4,3-a]quinoxaline
Compound characteristics
Compound ID: | E869-0177 |
Compound Name: | 4-(3,4-dihydroisoquinolin-2(1H)-yl)-1-ethyl[1,2,4]triazolo[4,3-a]quinoxaline |
Molecular Weight: | 329.4 |
Molecular Formula: | C20 H19 N5 |
Smiles: | CCc1nnc2c(nc3ccccc3n12)N1CCc2ccccc2C1 |
Stereo: | ACHIRAL |
logP: | 3.8434 |
logD: | 3.8324 |
logSw: | -3.8367 |
Hydrogen bond acceptors count: | 3 |
Polar surface area: | 33.944 |
InChI Key: | UXGGBTZEAVPQOX-UHFFFAOYSA-N |