N-(6-nitro-2-oxo-2H-1-benzopyran-3-yl)cyclohexanecarboxamide
Chemical Structure Depiction of
N-(6-nitro-2-oxo-2H-1-benzopyran-3-yl)cyclohexanecarboxamide
N-(6-nitro-2-oxo-2H-1-benzopyran-3-yl)cyclohexanecarboxamide
Compound characteristics
| Compound ID: | 2316-2067 |
| Compound Name: | N-(6-nitro-2-oxo-2H-1-benzopyran-3-yl)cyclohexanecarboxamide |
| Molecular Weight: | 316.31 |
| Molecular Formula: | C16 H16 N2 O5 |
| Smiles: | C1CCC(CC1)C(NC1=Cc2cc(ccc2OC1=O)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9606 |
| logD: | 2.9596 |
| logSw: | -3.4743 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.788 |
| InChI Key: | WHNVGOCGVSNNSR-UHFFFAOYSA-N |