N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]-4-nitrobenzamide
Chemical Structure Depiction of
N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]-4-nitrobenzamide
N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]-4-nitrobenzamide
Compound characteristics
Compound ID: | D220-0829 |
Compound Name: | N-[4-(4-methylphenyl)-1,2,5-oxadiazol-3-yl]-4-nitrobenzamide |
Molecular Weight: | 324.29 |
Molecular Formula: | C16 H12 N4 O4 |
Smiles: | [H]N(C(c1ccc(cc1)[N+]([O-])=O)=O)c1c(c2ccc(C)cc2)non1 |
Stereo: | ACHIRAL |
logP: | 3.9352 |
logD: | 3.8011 |
logSw: | -4.0164 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 93.468 |
InChI Key: | IGFVJVNMTVPMJH-UHFFFAOYSA-N |