N-(3-{3-ethoxy-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-4-nitrobenzamide
Chemical Structure Depiction of
N-(3-{3-ethoxy-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-4-nitrobenzamide
N-(3-{3-ethoxy-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-4-nitrobenzamide
Compound characteristics
Compound ID: | V025-1429 |
Compound Name: | N-(3-{3-ethoxy-5-[3-(trifluoromethyl)phenyl]-1H-1,2,4-triazol-1-yl}phenyl)-4-nitrobenzamide |
Molecular Weight: | 497.43 |
Molecular Formula: | C24 H18 F3 N5 O4 |
Salt: | not_available |
Smiles: | CCOc1nc(c2cccc(c2)C(F)(F)F)n(c2cccc(c2)NC(c2ccc(cc2)[N+]([O-])=O)=O)n1 |
Stereo: | ACHIRAL |
logP: | 6.1144 |
logD: | 6.1144 |
logSw: | -5.6404 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 87.286 |
InChI Key: | GPMOSNMRKVOIGP-UHFFFAOYSA-N |