N-cyclooctyl-4-methyl-3,5-dinitrobenzamide
Chemical Structure Depiction of
N-cyclooctyl-4-methyl-3,5-dinitrobenzamide
N-cyclooctyl-4-methyl-3,5-dinitrobenzamide
Compound characteristics
Compound ID: | 3365-0169 |
Compound Name: | N-cyclooctyl-4-methyl-3,5-dinitrobenzamide |
Molecular Weight: | 335.36 |
Molecular Formula: | C16 H21 N3 O5 |
Smiles: | Cc1c(cc(cc1[N+]([O-])=O)C(NC1CCCCCCC1)=O)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 3.8874 |
logD: | 3.8873 |
logSw: | -3.9996 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 90.869 |
InChI Key: | IFODSDYCTOLJFX-UHFFFAOYSA-N |