2-bromo-N-[3-(3-chloro-4-methoxyanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Chemical Structure Depiction of
2-bromo-N-[3-(3-chloro-4-methoxyanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
2-bromo-N-[3-(3-chloro-4-methoxyanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Compound characteristics
| Compound ID: | 2447-2790 |
| Compound Name: | 2-bromo-N-[3-(3-chloro-4-methoxyanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide |
| Molecular Weight: | 530.76 |
| Molecular Formula: | C23 H17 Br Cl N3 O5 |
| Smiles: | COc1ccc(cc1[Cl])NC(/C(=C/c1cccc(c1)[N+]([O-])=O)NC(c1ccccc1[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9035 |
| logD: | 4.2197 |
| logSw: | -4.9729 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.266 |
| InChI Key: | DJRGVQFKCHXBHE-UHFFFAOYSA-N |