N-(5-nitropyridin-2-yl)-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-(5-nitropyridin-2-yl)-2H-1,3-benzodioxole-5-carboxamide
N-(5-nitropyridin-2-yl)-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | Y203-9006 |
| Compound Name: | N-(5-nitropyridin-2-yl)-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 287.23 |
| Molecular Formula: | C13 H9 N3 O5 |
| Smiles: | C1Oc2ccc(cc2O1)C(Nc1ccc(cn1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5447 |
| logD: | 2.1816 |
| logSw: | -2.983 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.531 |
| InChI Key: | XDNXEOGLZNIQLH-UHFFFAOYSA-N |