4-{[2-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)hydrazinylidene]methyl}-2-methoxy-3-nitrophenyl acetate
Chemical Structure Depiction of
4-{[2-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)hydrazinylidene]methyl}-2-methoxy-3-nitrophenyl acetate
4-{[2-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)hydrazinylidene]methyl}-2-methoxy-3-nitrophenyl acetate
Compound characteristics
| Compound ID: | 1318-0199 |
| Compound Name: | 4-{[2-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)hydrazinylidene]methyl}-2-methoxy-3-nitrophenyl acetate |
| Molecular Weight: | 415.36 |
| Molecular Formula: | C19 H17 N3 O8 |
| Smiles: | CC(=O)Oc1ccc(/C=N/NC(C2COc3ccccc3O2)=O)c(c1OC)[N+]([O-])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1385 |
| logD: | 3.1262 |
| logSw: | -3.5128 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 112.326 |
| InChI Key: | FSABHEIBGOSGCQ-INIZCTEOSA-N |