N-[3-(2-bromo-4-methylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-3-chlorobenzamide
Chemical Structure Depiction of
N-[3-(2-bromo-4-methylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-3-chlorobenzamide
N-[3-(2-bromo-4-methylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-3-chlorobenzamide
Compound characteristics
Compound ID: | 2681-3583 |
Compound Name: | N-[3-(2-bromo-4-methylanilino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-3-chlorobenzamide |
Molecular Weight: | 514.76 |
Molecular Formula: | C23 H17 Br Cl N3 O4 |
Smiles: | Cc1ccc(c(c1)[Br])NC(/C(=C/c1cccc(c1)[N+]([O-])=O)NC(c1cccc(c1)[Cl])=O)=O |
Stereo: | ACHIRAL |
logP: | 5.726 |
logD: | 4.2305 |
logSw: | -5.9885 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 77.938 |
InChI Key: | DXQDIDPEKDNARD-UHFFFAOYSA-N |