{4-[4-(4-nitrophenyl)piperazin-1-yl][1,2,4]triazolo[4,3-a]quinoxalin-8-yl}(phenyl)methanone
Chemical Structure Depiction of
{4-[4-(4-nitrophenyl)piperazin-1-yl][1,2,4]triazolo[4,3-a]quinoxalin-8-yl}(phenyl)methanone
{4-[4-(4-nitrophenyl)piperazin-1-yl][1,2,4]triazolo[4,3-a]quinoxalin-8-yl}(phenyl)methanone
Compound characteristics
| Compound ID: | C301-2318 |
| Compound Name: | {4-[4-(4-nitrophenyl)piperazin-1-yl][1,2,4]triazolo[4,3-a]quinoxalin-8-yl}(phenyl)methanone |
| Molecular Weight: | 479.5 |
| Molecular Formula: | C26 H21 N7 O3 |
| Smiles: | C1CN(CCN1c1ccc(cc1)[N+]([O-])=O)c1c2nncn2c2cc(ccc2n1)C(c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4616 |
| logD: | 4.4616 |
| logSw: | -4.5513 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 84.021 |
| InChI Key: | WHGIXRMLVXCRLS-UHFFFAOYSA-N |