3-{2-[(3-chloro-2-methylanilino)(oxo)acetyl]hydrazinylidene}-N-(2-methyl-5-nitrophenyl)butanamide
Chemical Structure Depiction of
3-{2-[(3-chloro-2-methylanilino)(oxo)acetyl]hydrazinylidene}-N-(2-methyl-5-nitrophenyl)butanamide
3-{2-[(3-chloro-2-methylanilino)(oxo)acetyl]hydrazinylidene}-N-(2-methyl-5-nitrophenyl)butanamide
Compound characteristics
| Compound ID: | 8004-0095 |
| Compound Name: | 3-{2-[(3-chloro-2-methylanilino)(oxo)acetyl]hydrazinylidene}-N-(2-methyl-5-nitrophenyl)butanamide |
| Molecular Weight: | 445.86 |
| Molecular Formula: | C20 H20 Cl N5 O5 |
| Smiles: | C\C(CC(Nc1cc(ccc1C)[N+]([O-])=O)=O)=N/NC(C(Nc1cccc(c1C)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9237 |
| logD: | 1.8779 |
| logSw: | -3.45 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 113.421 |
| InChI Key: | NQESUNUNYVHDIC-UHFFFAOYSA-N |