3-{3-[4-(acetyloxy)phenyl]-2-benzamidoprop-2-enamido}benzoic acid
Chemical Structure Depiction of
3-{3-[4-(acetyloxy)phenyl]-2-benzamidoprop-2-enamido}benzoic acid
3-{3-[4-(acetyloxy)phenyl]-2-benzamidoprop-2-enamido}benzoic acid
Compound characteristics
| Compound ID: | 3379-2105 |
| Compound Name: | 3-{3-[4-(acetyloxy)phenyl]-2-benzamidoprop-2-enamido}benzoic acid |
| Molecular Weight: | 444.44 |
| Molecular Formula: | C25 H20 N2 O6 |
| Smiles: | CC(=O)Oc1ccc(\C=C(/C(Nc2cccc(c2)C(O)=O)=O)NC(c2ccccc2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7734 |
| logD: | 0.8876 |
| logSw: | -4.082 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 94.413 |
| InChI Key: | JVFWQSLOLPMVLS-UHFFFAOYSA-N |