N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enamide
Chemical Structure Depiction of
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enamide
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enamide
Compound characteristics
| Compound ID: | Y505-4560 |
| Compound Name: | N-[2-chloro-5-(trifluoromethyl)phenyl]-2-cyano-3-[5-(3-nitrophenyl)furan-2-yl]prop-2-enamide |
| Molecular Weight: | 461.78 |
| Molecular Formula: | C21 H11 Cl F3 N3 O4 |
| Smiles: | C(=C(/C#N)C(Nc1cc(ccc1[Cl])C(F)(F)F)=O)/c1ccc(c2cccc(c2)[N+]([O-])=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 6.0111 |
| logD: | 4.2308 |
| logSw: | -6.508 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.639 |
| InChI Key: | CEBXPDWWNMZUKQ-UHFFFAOYSA-N |