3-{2-[(3-chloro-4-methylanilino)(oxo)acetyl]hydrazinylidene}-N-(4-methoxy-2-nitrophenyl)butanamide
Chemical Structure Depiction of
3-{2-[(3-chloro-4-methylanilino)(oxo)acetyl]hydrazinylidene}-N-(4-methoxy-2-nitrophenyl)butanamide
3-{2-[(3-chloro-4-methylanilino)(oxo)acetyl]hydrazinylidene}-N-(4-methoxy-2-nitrophenyl)butanamide
Compound characteristics
| Compound ID: | 8002-2236 |
| Compound Name: | 3-{2-[(3-chloro-4-methylanilino)(oxo)acetyl]hydrazinylidene}-N-(4-methoxy-2-nitrophenyl)butanamide |
| Molecular Weight: | 461.86 |
| Molecular Formula: | C20 H20 Cl N5 O6 |
| Smiles: | C\C(CC(Nc1ccc(cc1[N+]([O-])=O)OC)=O)=N/NC(C(Nc1ccc(C)c(c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.657 |
| logD: | 2.7166 |
| logSw: | -4.0012 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 121.362 |
| InChI Key: | IUYIBOQSNYAJJC-UHFFFAOYSA-N |