3-[5-(2-chloro-5-nitrophenyl)furan-2-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide
Chemical Structure Depiction of
3-[5-(2-chloro-5-nitrophenyl)furan-2-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide
3-[5-(2-chloro-5-nitrophenyl)furan-2-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide
Compound characteristics
| Compound ID: | Y505-4520 |
| Compound Name: | 3-[5-(2-chloro-5-nitrophenyl)furan-2-yl]-N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyanoprop-2-enamide |
| Molecular Weight: | 496.23 |
| Molecular Formula: | C21 H10 Cl2 F3 N3 O4 |
| Smiles: | C(=C(/C#N)C(Nc1cc(ccc1[Cl])C(F)(F)F)=O)/c1ccc(c2cc(ccc2[Cl])[N+]([O-])=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 6.5098 |
| logD: | 4.7295 |
| logSw: | -6.5961 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.639 |
| InChI Key: | BZIJNMCPMYDBOI-UHFFFAOYSA-N |