N-[4-(3,4-dimethylphenyl)-1,2,5-oxadiazol-3-yl]-2-(2-nitrophenoxy)acetamide
Chemical Structure Depiction of
N-[4-(3,4-dimethylphenyl)-1,2,5-oxadiazol-3-yl]-2-(2-nitrophenoxy)acetamide
N-[4-(3,4-dimethylphenyl)-1,2,5-oxadiazol-3-yl]-2-(2-nitrophenoxy)acetamide
Compound characteristics
Compound ID: | D370-0100 |
Compound Name: | N-[4-(3,4-dimethylphenyl)-1,2,5-oxadiazol-3-yl]-2-(2-nitrophenoxy)acetamide |
Molecular Weight: | 368.35 |
Molecular Formula: | C18 H16 N4 O5 |
Smiles: | [H]N(C(COc1ccccc1[N+]([O-])=O)=O)c1c(c2ccc(C)c(C)c2)non1 |
Stereo: | ACHIRAL |
logP: | 4.418 |
logD: | 4.4173 |
logSw: | -4.4365 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 100.539 |
InChI Key: | HNLBOJUSWNDEIA-UHFFFAOYSA-N |