N-methyl-8-nitro-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-methyl-8-nitro-2-oxo-2H-1-benzopyran-3-carboxamide
N-methyl-8-nitro-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 8018-1235 |
| Compound Name: | N-methyl-8-nitro-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 248.19 |
| Molecular Formula: | C11 H8 N2 O5 |
| Smiles: | CNC(C1=Cc2cccc(c2OC1=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9275 |
| logD: | 0.9275 |
| logSw: | -2.0599 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.76 |
| InChI Key: | DKQMMXOXGZYUBE-UHFFFAOYSA-N |