N-[3-(4-bromo-3-methylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide
Chemical Structure Depiction of
N-[3-(4-bromo-3-methylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide
N-[3-(4-bromo-3-methylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide
Compound characteristics
| Compound ID: | 2628-3187 |
| Compound Name: | N-[3-(4-bromo-3-methylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-chlorobenzamide |
| Molecular Weight: | 514.76 |
| Molecular Formula: | C23 H17 Br Cl N3 O4 |
| Smiles: | Cc1cc(ccc1[Br])NC(/C(=C\c1cccc(c1)[N+]([O-])=O)NC(c1ccccc1[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7133 |
| logD: | 5.0295 |
| logSw: | -5.8797 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.636 |
| InChI Key: | YXIUJXDBIVPERU-UHFFFAOYSA-N |