2-chloro-N-[3-(2,4-dimethoxyanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-5-nitrobenzamide
Chemical Structure Depiction of
2-chloro-N-[3-(2,4-dimethoxyanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-5-nitrobenzamide
2-chloro-N-[3-(2,4-dimethoxyanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-5-nitrobenzamide
Compound characteristics
| Compound ID: | 2733-3709 |
| Compound Name: | 2-chloro-N-[3-(2,4-dimethoxyanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-5-nitrobenzamide |
| Molecular Weight: | 526.89 |
| Molecular Formula: | C24 H19 Cl N4 O8 |
| Smiles: | COc1ccc(c(c1)OC)NC(/C(=C/c1cccc(c1)[N+]([O-])=O)NC(c1cc(ccc1[Cl])[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4992 |
| logD: | 3.0659 |
| logSw: | -4.815 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 126.494 |
| InChI Key: | DUINKQCKDHJIKR-UHFFFAOYSA-N |