8-chloro-4-[4-(4-nitrophenyl)piperazin-1-yl][1,2,4]triazolo[4,3-a]quinoxaline
Chemical Structure Depiction of
8-chloro-4-[4-(4-nitrophenyl)piperazin-1-yl][1,2,4]triazolo[4,3-a]quinoxaline
8-chloro-4-[4-(4-nitrophenyl)piperazin-1-yl][1,2,4]triazolo[4,3-a]quinoxaline
Compound characteristics
Compound ID: | C301-1454 |
Compound Name: | 8-chloro-4-[4-(4-nitrophenyl)piperazin-1-yl][1,2,4]triazolo[4,3-a]quinoxaline |
Molecular Weight: | 409.83 |
Molecular Formula: | C19 H16 Cl N7 O2 |
Smiles: | C1CN(CCN1c1ccc(cc1)[N+]([O-])=O)c1c2nncn2c2cc(ccc2n1)[Cl] |
Stereo: | ACHIRAL |
logP: | 3.831 |
logD: | 3.8268 |
logSw: | -4.2509 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 70.553 |
InChI Key: | AILMLJWULVQBGY-UHFFFAOYSA-N |