5-methyl-4-nitro-N-[4-(trifluoromethoxy)phenyl]-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
5-methyl-4-nitro-N-[4-(trifluoromethoxy)phenyl]-1,2-oxazole-3-carboxamide
5-methyl-4-nitro-N-[4-(trifluoromethoxy)phenyl]-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | C582-0775 |
| Compound Name: | 5-methyl-4-nitro-N-[4-(trifluoromethoxy)phenyl]-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 331.2 |
| Molecular Formula: | C12 H8 F3 N3 O5 |
| Smiles: | Cc1c(c(C(Nc2ccc(cc2)OC(F)(F)F)=O)no1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2816 |
| logD: | 3.277 |
| logSw: | -3.8294 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.278 |
| InChI Key: | YWYLZGSWLGFBMH-UHFFFAOYSA-N |