2-chloro-N-[3-(4-chloro-3-nitroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
Chemical Structure Depiction of
2-chloro-N-[3-(4-chloro-3-nitroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
2-chloro-N-[3-(4-chloro-3-nitroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
Compound characteristics
| Compound ID: | 2628-3228 |
| Compound Name: | 2-chloro-N-[3-(4-chloro-3-nitroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide |
| Molecular Weight: | 531.31 |
| Molecular Formula: | C23 H16 Cl2 N4 O7 |
| Smiles: | COc1ccc(C(NC(=C\c2ccc(cc2)[N+]([O-])=O)\C(Nc2ccc(c(c2)[N+]([O-])=O)[Cl])=O)=O)c(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.0964 |
| logD: | 3.564 |
| logSw: | -5.587 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 119.26 |
| InChI Key: | QZGOLSVENRZJGM-UHFFFAOYSA-N |