4-{2-[5-(2,5-dimethyl-4-nitrophenyl)furan-2-yl]ethenyl}-6-(trifluoromethyl)pyrimidin-2(1H)-one
Chemical Structure Depiction of
4-{2-[5-(2,5-dimethyl-4-nitrophenyl)furan-2-yl]ethenyl}-6-(trifluoromethyl)pyrimidin-2(1H)-one
4-{2-[5-(2,5-dimethyl-4-nitrophenyl)furan-2-yl]ethenyl}-6-(trifluoromethyl)pyrimidin-2(1H)-one
Compound characteristics
| Compound ID: | 3448-8793 |
| Compound Name: | 4-{2-[5-(2,5-dimethyl-4-nitrophenyl)furan-2-yl]ethenyl}-6-(trifluoromethyl)pyrimidin-2(1H)-one |
| Molecular Weight: | 405.33 |
| Molecular Formula: | C19 H14 F3 N3 O4 |
| Smiles: | Cc1cc(c(C)cc1c1ccc(/C=C/C2C=C(C(F)(F)F)NC(N=2)=O)o1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.3714 |
| logD: | 1.2759 |
| logSw: | -5.47 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.715 |
| InChI Key: | DZITXZPYJSRQFQ-UHFFFAOYSA-N |