6-nitro-2-oxo-N-[(oxolan-2-yl)methyl]-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
6-nitro-2-oxo-N-[(oxolan-2-yl)methyl]-2H-1-benzopyran-3-carboxamide
6-nitro-2-oxo-N-[(oxolan-2-yl)methyl]-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 8015-0561 |
| Compound Name: | 6-nitro-2-oxo-N-[(oxolan-2-yl)methyl]-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 318.28 |
| Molecular Formula: | C15 H14 N2 O6 |
| Smiles: | C1CC(CNC(C2=Cc3cc(ccc3OC2=O)[N+]([O-])=O)=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.9626 |
| logD: | 0.9625 |
| logSw: | -2.3033 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.609 |
| InChI Key: | IIJNGVJEDUBHGK-LLVKDONJSA-N |