4-bromo-N-[1-(2-fluorophenyl)-3-(2-methyl-5-nitroanilino)-3-oxoprop-1-en-2-yl]benzamide
Chemical Structure Depiction of
4-bromo-N-[1-(2-fluorophenyl)-3-(2-methyl-5-nitroanilino)-3-oxoprop-1-en-2-yl]benzamide
4-bromo-N-[1-(2-fluorophenyl)-3-(2-methyl-5-nitroanilino)-3-oxoprop-1-en-2-yl]benzamide
Compound characteristics
Compound ID: | 2339-2251 |
Compound Name: | 4-bromo-N-[1-(2-fluorophenyl)-3-(2-methyl-5-nitroanilino)-3-oxoprop-1-en-2-yl]benzamide |
Molecular Weight: | 498.31 |
Molecular Formula: | C23 H17 Br F N3 O4 |
Smiles: | Cc1ccc(cc1NC(/C(=C/c1ccccc1F)NC(c1ccc(cc1)[Br])=O)=O)[N+]([O-])=O |
Stereo: | ACHIRAL |
logP: | 5.2497 |
logD: | 4.2976 |
logSw: | -5.0858 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 77.938 |
InChI Key: | KYWSMOJVHOGJOT-UHFFFAOYSA-N |