5-(6-bromo-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-4-methyl-N'-{(E)-[2-(trifluoromethyl)phenyl]methylidene}-4,5-dihydro-1,2-oxazole-3-carbohydrazide
Chemical Structure Depiction of
5-(6-bromo-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-4-methyl-N'-{(E)-[2-(trifluoromethyl)phenyl]methylidene}-4,5-dihydro-1,2-oxazole-3-carbohydrazide
5-(6-bromo-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-4-methyl-N'-{(E)-[2-(trifluoromethyl)phenyl]methylidene}-4,5-dihydro-1,2-oxazole-3-carbohydrazide
Compound characteristics
| Compound ID: | 8019-6192 |
| Compound Name: | 5-(6-bromo-4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)-4-methyl-N'-{(E)-[2-(trifluoromethyl)phenyl]methylidene}-4,5-dihydro-1,2-oxazole-3-carbohydrazide |
| Molecular Weight: | 558.31 |
| Molecular Formula: | C22 H19 Br F3 N3 O6 |
| Smiles: | CC1C(c2c(c3c(c(c2[Br])OC)OCO3)OC)ON=C1C(N/N=C/c1ccccc1C(F)(F)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2012 |
| logD: | 5.129 |
| logSw: | -5.0308 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.879 |
| InChI Key: | GALYMCJUDGCQTJ-UHFFFAOYSA-N |