3-methyl-N-{4-methyl-2-[3-(trifluoromethyl)anilino]quinolin-6-yl}-4-nitrobenzamide
Chemical Structure Depiction of
3-methyl-N-{4-methyl-2-[3-(trifluoromethyl)anilino]quinolin-6-yl}-4-nitrobenzamide
3-methyl-N-{4-methyl-2-[3-(trifluoromethyl)anilino]quinolin-6-yl}-4-nitrobenzamide
Compound characteristics
| Compound ID: | E683-0150 |
| Compound Name: | 3-methyl-N-{4-methyl-2-[3-(trifluoromethyl)anilino]quinolin-6-yl}-4-nitrobenzamide |
| Molecular Weight: | 480.45 |
| Molecular Formula: | C25 H19 F3 N4 O3 |
| Smiles: | Cc1cc(ccc1[N+]([O-])=O)C(Nc1ccc2c(c1)c(C)cc(Nc1cccc(c1)C(F)(F)F)n2)=O |
| Stereo: | ACHIRAL |
| logP: | 7.2696 |
| logD: | 7.2588 |
| logSw: | -5.8848 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.22 |
| InChI Key: | XOTGUIVRZXEWER-UHFFFAOYSA-N |