2-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-8-[(3-methylphenyl)sulfanyl][1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Chemical Structure Depiction of
2-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-8-[(3-methylphenyl)sulfanyl][1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
2-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-8-[(3-methylphenyl)sulfanyl][1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one
Compound characteristics
Compound ID: | M451-0870 |
Compound Name: | 2-{2-[4-(2-fluorophenyl)piperazin-1-yl]-2-oxoethyl}-8-[(3-methylphenyl)sulfanyl][1,2,4]triazolo[4,3-a]pyrazin-3(2H)-one |
Molecular Weight: | 478.55 |
Molecular Formula: | C24 H23 F N6 O2 S |
Smiles: | Cc1cccc(c1)SC1C2=NN(CC(N3CCN(CC3)c3ccccc3F)=O)C(N2C=CN=1)=O |
Stereo: | ACHIRAL |
logP: | 2.8029 |
logD: | 2.8029 |
logSw: | -3.2607 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 58.789 |
InChI Key: | ADDFIGUWMSSYOV-UHFFFAOYSA-N |