5-bromo-2-methoxy-N-[3-(3-methylanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Chemical Structure Depiction of
5-bromo-2-methoxy-N-[3-(3-methylanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
5-bromo-2-methoxy-N-[3-(3-methylanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide
Compound characteristics
| Compound ID: | 2681-3570 |
| Compound Name: | 5-bromo-2-methoxy-N-[3-(3-methylanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]benzamide |
| Molecular Weight: | 510.34 |
| Molecular Formula: | C24 H20 Br N3 O5 |
| Smiles: | Cc1cccc(c1)NC(/C(=C/c1ccc(cc1)[N+]([O-])=O)NC(c1cc(ccc1OC)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.421 |
| logD: | 3.7583 |
| logSw: | -5.5152 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.266 |
| InChI Key: | XPVCGZQTWALIOL-UHFFFAOYSA-N |