3,4-dimethyl-N-(6-nitro-2-oxo-2H-1-benzopyran-3-yl)benzamide
Chemical Structure Depiction of
3,4-dimethyl-N-(6-nitro-2-oxo-2H-1-benzopyran-3-yl)benzamide
3,4-dimethyl-N-(6-nitro-2-oxo-2H-1-benzopyran-3-yl)benzamide
Compound characteristics
| Compound ID: | 2290-1634 |
| Compound Name: | 3,4-dimethyl-N-(6-nitro-2-oxo-2H-1-benzopyran-3-yl)benzamide |
| Molecular Weight: | 338.32 |
| Molecular Formula: | C18 H14 N2 O5 |
| Smiles: | Cc1ccc(cc1C)C(NC1=Cc2cc(ccc2OC1=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6525 |
| logD: | 3.6249 |
| logSw: | -3.9119 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.596 |
| InChI Key: | JFMLOXULFNVTIX-UHFFFAOYSA-N |