5-bromo-N-[3-(2,4-difluoroanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-methoxybenzamide
Chemical Structure Depiction of
5-bromo-N-[3-(2,4-difluoroanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-methoxybenzamide
5-bromo-N-[3-(2,4-difluoroanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-methoxybenzamide
Compound characteristics
| Compound ID: | 2733-3724 |
| Compound Name: | 5-bromo-N-[3-(2,4-difluoroanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-methoxybenzamide |
| Molecular Weight: | 532.3 |
| Molecular Formula: | C23 H16 Br F2 N3 O5 |
| Smiles: | COc1ccc(cc1C(NC(=C/c1cccc(c1)[N+]([O-])=O)\C(Nc1ccc(cc1F)F)=O)=O)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.0579 |
| logD: | 2.2931 |
| logSw: | -4.8028 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.568 |
| InChI Key: | LTAUXZFQPNAOKO-UHFFFAOYSA-N |