1-(2-fluorophenyl)-4-(5-nitro-3-oxo-2-phenyl-2H-1lambda~5~,2,3-triazol-4-yl)piperazine
Chemical Structure Depiction of
1-(2-fluorophenyl)-4-(5-nitro-3-oxo-2-phenyl-2H-1lambda~5~,2,3-triazol-4-yl)piperazine
1-(2-fluorophenyl)-4-(5-nitro-3-oxo-2-phenyl-2H-1lambda~5~,2,3-triazol-4-yl)piperazine
Compound characteristics
Compound ID: | C359-0114 |
Compound Name: | 1-(2-fluorophenyl)-4-(5-nitro-3-oxo-2-phenyl-2H-1lambda~5~,2,3-triazol-4-yl)piperazine |
Molecular Weight: | 384.37 |
Molecular Formula: | C18 H17 F N6 O3 |
Smiles: | C1CN(CCN1c1ccccc1F)c1c(nn(c2ccccc2)[n+]1[O-])[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 3.393 |
logD: | 3.3929 |
logSw: | -3.6169 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 72.717 |
InChI Key: | LCUFTERIYWZIDO-UHFFFAOYSA-N |