N-[3-(3-fluoroanilino)-1-(2-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxy-3-nitrobenzamide
Chemical Structure Depiction of
N-[3-(3-fluoroanilino)-1-(2-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxy-3-nitrobenzamide
N-[3-(3-fluoroanilino)-1-(2-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxy-3-nitrobenzamide
Compound characteristics
| Compound ID: | 2871-3867 |
| Compound Name: | N-[3-(3-fluoroanilino)-1-(2-nitrophenyl)-3-oxoprop-1-en-2-yl]-4-methoxy-3-nitrobenzamide |
| Molecular Weight: | 480.41 |
| Molecular Formula: | C23 H17 F N4 O7 |
| Smiles: | COc1ccc(cc1[N+]([O-])=O)C(NC(=C/c1ccccc1[N+]([O-])=O)\C(Nc1cccc(c1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7317 |
| logD: | 2.2722 |
| logSw: | -4.1704 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 119.046 |
| InChI Key: | CBGITALQXUPNJT-UHFFFAOYSA-N |