ethyl 5-[(6,7-dimethoxy-4-{[2-(3-nitrobenzoyl)hydrazinylidene]methyl}-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[(6,7-dimethoxy-4-{[2-(3-nitrobenzoyl)hydrazinylidene]methyl}-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazole-3-carboxylate
ethyl 5-[(6,7-dimethoxy-4-{[2-(3-nitrobenzoyl)hydrazinylidene]methyl}-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazole-3-carboxylate
Compound characteristics
| Compound ID: | 8019-6880 |
| Compound Name: | ethyl 5-[(6,7-dimethoxy-4-{[2-(3-nitrobenzoyl)hydrazinylidene]methyl}-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazole-3-carboxylate |
| Molecular Weight: | 528.47 |
| Molecular Formula: | C24 H24 N4 O10 |
| Smiles: | CCOC(C1CC(Cc2c(\C=N/NC(c3cccc(c3)[N+]([O-])=O)=O)c3c(c(c2OC)OC)OCO3)ON=1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0009 |
| logD: | 3.9771 |
| logSw: | -4.2294 |
| Hydrogen bond acceptors count: | 16 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 144.443 |
| InChI Key: | YQPLJSBZYROZST-HNNXBMFYSA-N |