N-(4-fluoro-3-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Chemical Structure Depiction of
N-(4-fluoro-3-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
N-(4-fluoro-3-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Compound characteristics
| Compound ID: | 3617-0841 |
| Compound Name: | N-(4-fluoro-3-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide |
| Molecular Weight: | 318.26 |
| Molecular Formula: | C15 H11 F N2 O5 |
| Smiles: | C1COc2cc(ccc2O1)C(Nc1ccc(c(c1)[N+]([O-])=O)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0423 |
| logD: | 1.8672 |
| logSw: | -2.9373 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.233 |
| InChI Key: | VEQKOWNIUMVGLZ-UHFFFAOYSA-N |