2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}quinoxaline
Chemical Structure Depiction of
2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}quinoxaline
2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}quinoxaline
Compound characteristics
| Compound ID: | C301-3450 |
| Compound Name: | 2-(3,5-dimethyl-1H-pyrazol-1-yl)-3-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}quinoxaline |
| Molecular Weight: | 497.48 |
| Molecular Formula: | C24 H22 F3 N7 O2 |
| Smiles: | Cc1cc(C)n(c2c(nc3ccccc3n2)N2CCN(CC2)c2ccc(cc2[N+]([O-])=O)C(F)(F)F)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.2311 |
| logD: | 5.2309 |
| logSw: | -5.2622 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 70.401 |
| InChI Key: | WDLWVQBUHLVNPQ-UHFFFAOYSA-N |