2-chloro-N-[3-(4-fluoroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
Chemical Structure Depiction of
2-chloro-N-[3-(4-fluoroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
2-chloro-N-[3-(4-fluoroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
Compound characteristics
Compound ID: | 2628-3212 |
Compound Name: | 2-chloro-N-[3-(4-fluoroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide |
Molecular Weight: | 469.86 |
Molecular Formula: | C23 H17 Cl F N3 O5 |
Smiles: | COc1ccc(C(NC(=C\c2ccc(cc2)[N+]([O-])=O)\C(Nc2ccc(cc2)F)=O)=O)c(c1)[Cl] |
Stereo: | ACHIRAL |
logP: | 4.8508 |
logD: | 4.4926 |
logSw: | -5.1256 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 86.179 |
InChI Key: | ZDZVVYURKIIFOR-UHFFFAOYSA-N |