2-chloro-4-fluoro-N-[3-(4-nitroanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Chemical Structure Depiction of
2-chloro-4-fluoro-N-[3-(4-nitroanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
2-chloro-4-fluoro-N-[3-(4-nitroanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Compound characteristics
| Compound ID: | 2681-3508 |
| Compound Name: | 2-chloro-4-fluoro-N-[3-(4-nitroanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide |
| Molecular Weight: | 484.83 |
| Molecular Formula: | C22 H14 Cl F N4 O6 |
| Smiles: | C(=C(/C(Nc1ccc(cc1)[N+]([O-])=O)=O)NC(c1ccc(cc1[Cl])F)=O)\c1cccc(c1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.6761 |
| logD: | 3.1408 |
| logSw: | -5.2098 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 112.017 |
| InChI Key: | KZRUKZHJIFGTJO-UHFFFAOYSA-N |