7-fluoro-4-oxo-N-{[3-(trifluoromethyl)phenyl]methyl}-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide
Chemical Structure Depiction of
7-fluoro-4-oxo-N-{[3-(trifluoromethyl)phenyl]methyl}-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide
7-fluoro-4-oxo-N-{[3-(trifluoromethyl)phenyl]methyl}-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide
Compound characteristics
Compound ID: | P516-0274 |
Compound Name: | 7-fluoro-4-oxo-N-{[3-(trifluoromethyl)phenyl]methyl}-4,5-dihydro[1,2,3]triazolo[1,5-a]quinoxaline-3-carboxamide |
Molecular Weight: | 405.31 |
Molecular Formula: | C18 H11 F4 N5 O2 |
Smiles: | C(c1cccc(c1)C(F)(F)F)NC(c1c2C(Nc3cc(ccc3n2nn1)F)=O)=O |
Stereo: | ACHIRAL |
logP: | 2.6668 |
logD: | 1.8767 |
logSw: | -3.1369 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 74.671 |
InChI Key: | QEOYEYMOSXBVHR-UHFFFAOYSA-N |