4-methoxy-N-(2-methyl-4-nitrophenyl)-3-nitrobenzamide
Chemical Structure Depiction of
4-methoxy-N-(2-methyl-4-nitrophenyl)-3-nitrobenzamide
4-methoxy-N-(2-methyl-4-nitrophenyl)-3-nitrobenzamide
Compound characteristics
Compound ID: | 2081-1031 |
Compound Name: | 4-methoxy-N-(2-methyl-4-nitrophenyl)-3-nitrobenzamide |
Molecular Weight: | 331.28 |
Molecular Formula: | C15 H13 N3 O6 |
Smiles: | Cc1cc(ccc1NC(c1ccc(c(c1)[N+]([O-])=O)OC)=O)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 2.6935 |
logD: | 2.2847 |
logSw: | -3.1466 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 96.724 |
InChI Key: | STBCZQFPVBKLHW-UHFFFAOYSA-N |