4-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}[1,2,4]triazolo[4,3-a]quinoxaline
Chemical Structure Depiction of
4-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}[1,2,4]triazolo[4,3-a]quinoxaline
4-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}[1,2,4]triazolo[4,3-a]quinoxaline
Compound characteristics
| Compound ID: | C301-3416 |
| Compound Name: | 4-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}[1,2,4]triazolo[4,3-a]quinoxaline |
| Molecular Weight: | 443.39 |
| Molecular Formula: | C20 H16 F3 N7 O2 |
| Smiles: | C1CN(CCN1c1ccc(cc1[N+]([O-])=O)C(F)(F)F)c1c2nncn2c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 3.8501 |
| logD: | 3.8459 |
| logSw: | -4.2669 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 69.952 |
| InChI Key: | UKYRRHIBJGBQAD-UHFFFAOYSA-N |