N-(3-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Chemical Structure Depiction of
N-(3-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide
N-(3-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide
Compound characteristics
| Compound ID: | 1988-1206 |
| Compound Name: | N-(3-nitrophenyl)-2,3-dihydro-1,4-benzodioxine-2-carboxamide |
| Molecular Weight: | 300.27 |
| Molecular Formula: | C15 H12 N2 O5 |
| Smiles: | C1C(C(Nc2cccc(c2)[N+]([O-])=O)=O)Oc2ccccc2O1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9538 |
| logD: | 2.9477 |
| logSw: | -3.3577 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.148 |
| InChI Key: | ROZHPHAJMCSPIN-AWEZNQCLSA-N |