4-(3,4-dimethoxyphenyl)-2-(4-nitro-1H-imidazol-1-yl)-6-(trifluoromethyl)pyrimidine
Chemical Structure Depiction of
4-(3,4-dimethoxyphenyl)-2-(4-nitro-1H-imidazol-1-yl)-6-(trifluoromethyl)pyrimidine
4-(3,4-dimethoxyphenyl)-2-(4-nitro-1H-imidazol-1-yl)-6-(trifluoromethyl)pyrimidine
Compound characteristics
| Compound ID: | C226-4616 |
| Compound Name: | 4-(3,4-dimethoxyphenyl)-2-(4-nitro-1H-imidazol-1-yl)-6-(trifluoromethyl)pyrimidine |
| Molecular Weight: | 395.3 |
| Molecular Formula: | C16 H12 F3 N5 O4 |
| Smiles: | COc1ccc(cc1OC)c1cc(C(F)(F)F)nc(n1)n1cc(nc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2958 |
| logD: | 3.2955 |
| logSw: | -3.4738 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 77.809 |
| InChI Key: | UJJVFNULZDNJEP-UHFFFAOYSA-N |