ethyl 4-(3-{2-[(3-chloro-2-methylanilino)(oxo)acetyl]hydrazinylidene}butanamido)benzoate
Chemical Structure Depiction of
ethyl 4-(3-{2-[(3-chloro-2-methylanilino)(oxo)acetyl]hydrazinylidene}butanamido)benzoate
ethyl 4-(3-{2-[(3-chloro-2-methylanilino)(oxo)acetyl]hydrazinylidene}butanamido)benzoate
Compound characteristics
| Compound ID: | 8003-0752 |
| Compound Name: | ethyl 4-(3-{2-[(3-chloro-2-methylanilino)(oxo)acetyl]hydrazinylidene}butanamido)benzoate |
| Molecular Weight: | 458.9 |
| Molecular Formula: | C22 H23 Cl N4 O5 |
| Smiles: | CCOC(c1ccc(cc1)NC(CC(/C)=N/NC(C(Nc1cccc(c1C)[Cl])=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7292 |
| logD: | 2.6835 |
| logSw: | -4.1511 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 101.491 |
| InChI Key: | XODHCBOHZZEEHA-UHFFFAOYSA-N |