N-[3-(2-methoxy-4-nitroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Chemical Structure Depiction of
N-[3-(2-methoxy-4-nitroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
N-[3-(2-methoxy-4-nitroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Compound characteristics
Compound ID: | 2681-3487 |
Compound Name: | N-[3-(2-methoxy-4-nitroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide |
Molecular Weight: | 462.42 |
Molecular Formula: | C23 H18 N4 O7 |
Smiles: | COc1cc(ccc1NC(/C(=C/c1ccc(cc1)[N+]([O-])=O)NC(c1ccccc1)=O)=O)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 4.1095 |
logD: | 2.6162 |
logSw: | -4.3864 |
Hydrogen bond acceptors count: | 13 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 118.95 |
InChI Key: | LMANESAZPPUEAV-UHFFFAOYSA-N |