2-chloro-N-[3-(3-fluoroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
Chemical Structure Depiction of
2-chloro-N-[3-(3-fluoroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
2-chloro-N-[3-(3-fluoroanilino)-1-(4-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
Compound characteristics
| Compound ID: | 2628-3201 |
| Compound Name: | 2-chloro-N-[3-(3-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(Nc2cccc(c2)F)=O)=O)c(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.9751 |
| logD: | 4.6169 |
| logSw: | -5.2421 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.179 |
| InChI Key: | QPKVGDSJDKZSJY-UHFFFAOYSA-N |