N-[3-(2-bromoanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Chemical Structure Depiction of
N-[3-(2-bromoanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
N-[3-(2-bromoanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Compound characteristics
| Compound ID: | 2733-3729 |
| Compound Name: | N-[3-(2-bromoanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide |
| Molecular Weight: | 466.29 |
| Molecular Formula: | C22 H16 Br N3 O4 |
| Smiles: | C(=C(/C(Nc1ccccc1[Br])=O)NC(c1ccccc1)=O)\c1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5568 |
| logD: | 4.0029 |
| logSw: | -4.5777 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.938 |
| InChI Key: | QNHQHNWPICBPJY-UHFFFAOYSA-N |