N-[3-(2,5-dichloroanilino)-1-(2-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxy-3-nitrobenzamide
Chemical Structure Depiction of
N-[3-(2,5-dichloroanilino)-1-(2-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxy-3-nitrobenzamide
N-[3-(2,5-dichloroanilino)-1-(2-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxy-3-nitrobenzamide
Compound characteristics
| Compound ID: | 2871-3866 |
| Compound Name: | N-[3-(2,5-dichloroanilino)-1-(2-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxy-3-nitrobenzamide |
| Molecular Weight: | 531.31 |
| Molecular Formula: | C23 H16 Cl2 N4 O7 |
| Smiles: | COc1ccc(cc1[N+]([O-])=O)C(NC(=C/c1ccccc1[N+]([O-])=O)\C(Nc1cc(ccc1[Cl])[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6341 |
| logD: | 2.2486 |
| logSw: | -4.9682 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 118.348 |
| InChI Key: | UCZQFFBIOCSAPU-UHFFFAOYSA-N |