N-(6-methoxy-2-oxo-2H-1-benzopyran-3-yl)-3-nitrobenzamide
Chemical Structure Depiction of
N-(6-methoxy-2-oxo-2H-1-benzopyran-3-yl)-3-nitrobenzamide
N-(6-methoxy-2-oxo-2H-1-benzopyran-3-yl)-3-nitrobenzamide
Compound characteristics
Compound ID: | 1989-9272 |
Compound Name: | N-(6-methoxy-2-oxo-2H-1-benzopyran-3-yl)-3-nitrobenzamide |
Molecular Weight: | 340.29 |
Molecular Formula: | C17 H12 N2 O6 |
Smiles: | COc1ccc2c(C=C(C(=O)O2)NC(c2cccc(c2)[N+]([O-])=O)=O)c1 |
Stereo: | ACHIRAL |
logP: | 2.652 |
logD: | 2.6228 |
logSw: | -3.27 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 86.14 |
InChI Key: | LLWNMFRIANSGBF-UHFFFAOYSA-N |