N-[2-chloro-5-(trifluoromethyl)phenyl]-4-{2-[(2-hydroxy-5-nitrophenyl)methylidene]hydrazinyl}-4-oxobutanamide
Chemical Structure Depiction of
N-[2-chloro-5-(trifluoromethyl)phenyl]-4-{2-[(2-hydroxy-5-nitrophenyl)methylidene]hydrazinyl}-4-oxobutanamide
N-[2-chloro-5-(trifluoromethyl)phenyl]-4-{2-[(2-hydroxy-5-nitrophenyl)methylidene]hydrazinyl}-4-oxobutanamide
Compound characteristics
| Compound ID: | 1761-0531 |
| Compound Name: | N-[2-chloro-5-(trifluoromethyl)phenyl]-4-{2-[(2-hydroxy-5-nitrophenyl)methylidene]hydrazinyl}-4-oxobutanamide |
| Molecular Weight: | 458.78 |
| Molecular Formula: | C18 H14 Cl F3 N4 O5 |
| Smiles: | C(CC(N/N=C\c1cc(ccc1O)[N+]([O-])=O)=O)C(Nc1cc(ccc1[Cl])C(F)(F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4839 |
| logD: | 2.9073 |
| logSw: | -3.8104 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 107.722 |
| InChI Key: | VRFKREKLXZZFDW-UHFFFAOYSA-N |