ethyl N-{4-[3-(trifluoromethyl)quinoxalin-2-yl]piperazine-1-carbonyl}-beta-alaninate
Chemical Structure Depiction of
ethyl N-{4-[3-(trifluoromethyl)quinoxalin-2-yl]piperazine-1-carbonyl}-beta-alaninate
ethyl N-{4-[3-(trifluoromethyl)quinoxalin-2-yl]piperazine-1-carbonyl}-beta-alaninate
Compound characteristics
| Compound ID: | F070-1228 |
| Compound Name: | ethyl N-{4-[3-(trifluoromethyl)quinoxalin-2-yl]piperazine-1-carbonyl}-beta-alaninate |
| Molecular Weight: | 425.41 |
| Molecular Formula: | C19 H22 F3 N5 O3 |
| Smiles: | [H]c1cc2c(cc1[H])nc(c(C(F)(F)F)n2)N1CCN(CC1)C(NCCC(=O)OCC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9558 |
| logD: | 2.9558 |
| logSw: | -3.1414 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.198 |
| InChI Key: | NKSJEHJRFMCCEG-UHFFFAOYSA-N |