5-bromo-N-[3-(3-chloro-2-methylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-methoxybenzamide
Chemical Structure Depiction of
5-bromo-N-[3-(3-chloro-2-methylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-methoxybenzamide
5-bromo-N-[3-(3-chloro-2-methylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-methoxybenzamide
Compound characteristics
| Compound ID: | 2733-3734 |
| Compound Name: | 5-bromo-N-[3-(3-chloro-2-methylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-methoxybenzamide |
| Molecular Weight: | 544.79 |
| Molecular Formula: | C24 H19 Br Cl N3 O5 |
| Smiles: | Cc1c(cccc1[Cl])NC(/C(=C/c1cccc(c1)[N+]([O-])=O)NC(c1cc(ccc1OC)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9493 |
| logD: | 4.8117 |
| logSw: | -6.1009 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.568 |
| InChI Key: | GDRMFUZYDSLLQV-UHFFFAOYSA-N |