methyl 2-(3-{2-[(2-bromo-4-methylphenoxy)acetyl]hydrazinylidene}butanamido)benzoate
Chemical Structure Depiction of
methyl 2-(3-{2-[(2-bromo-4-methylphenoxy)acetyl]hydrazinylidene}butanamido)benzoate
methyl 2-(3-{2-[(2-bromo-4-methylphenoxy)acetyl]hydrazinylidene}butanamido)benzoate
Compound characteristics
| Compound ID: | 8005-4643 |
| Compound Name: | methyl 2-(3-{2-[(2-bromo-4-methylphenoxy)acetyl]hydrazinylidene}butanamido)benzoate |
| Molecular Weight: | 476.33 |
| Molecular Formula: | C21 H22 Br N3 O5 |
| Smiles: | C\C(CC(Nc1ccccc1C(=O)OC)=O)=N/NC(COc1ccc(C)cc1[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.3168 |
| logD: | 3.3061 |
| logSw: | -3.7503 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.921 |
| InChI Key: | YHDBCIQTIQOEGT-UHFFFAOYSA-N |