N-[1-(4-fluorophenyl)-3-(4-nitroanilino)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
Chemical Structure Depiction of
N-[1-(4-fluorophenyl)-3-(4-nitroanilino)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
N-[1-(4-fluorophenyl)-3-(4-nitroanilino)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
Compound characteristics
| Compound ID: | 2447-2990 |
| Compound Name: | N-[1-(4-fluorophenyl)-3-(4-nitroanilino)-3-oxoprop-1-en-2-yl]-4-methoxybenzamide |
| Molecular Weight: | 435.41 |
| Molecular Formula: | C23 H18 F N3 O5 |
| Smiles: | COc1ccc(cc1)C(NC(=C/c1ccc(cc1)F)\C(Nc1ccc(cc1)[N+]([O-])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2123 |
| logD: | 3.8944 |
| logSw: | -4.445 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.179 |
| InChI Key: | KDEOMXMWSCOQQA-UHFFFAOYSA-N |