3-bromo-N-[3-(3-fluoro-4-methylanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
Chemical Structure Depiction of
3-bromo-N-[3-(3-fluoro-4-methylanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
3-bromo-N-[3-(3-fluoro-4-methylanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
Compound characteristics
| Compound ID: | 2681-3451 |
| Compound Name: | 3-bromo-N-[3-(3-fluoro-4-methylanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide |
| Molecular Weight: | 528.33 |
| Molecular Formula: | C24 H19 Br F N3 O5 |
| Smiles: | Cc1ccc(cc1F)NC(/C(=C/c1ccc(cc1)[N+]([O-])=O)NC(c1ccc(c(c1)[Br])OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4887 |
| logD: | 5.1531 |
| logSw: | -5.5187 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.266 |
| InChI Key: | IMNYHFVYYKQBNR-UHFFFAOYSA-N |