N-(8-nitro-2-oxo-2H-1-benzopyran-3-yl)cyclohexanecarboxamide
Chemical Structure Depiction of
N-(8-nitro-2-oxo-2H-1-benzopyran-3-yl)cyclohexanecarboxamide
N-(8-nitro-2-oxo-2H-1-benzopyran-3-yl)cyclohexanecarboxamide
Compound characteristics
Compound ID: | 2316-2068 |
Compound Name: | N-(8-nitro-2-oxo-2H-1-benzopyran-3-yl)cyclohexanecarboxamide |
Molecular Weight: | 316.31 |
Molecular Formula: | C16 H16 N2 O5 |
Smiles: | C1CCC(CC1)C(NC1=Cc2cccc(c2OC1=O)[N+]([O-])=O)=O |
Stereo: | ACHIRAL |
logP: | 3.078 |
logD: | 3.077 |
logSw: | -3.5433 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 78.172 |
InChI Key: | LQJGAAUUZJOYQL-UHFFFAOYSA-N |