3-{2-[3-(4-nitrophenyl)prop-2-enamido]benzamido}benzoic acid
Chemical Structure Depiction of
3-{2-[3-(4-nitrophenyl)prop-2-enamido]benzamido}benzoic acid
3-{2-[3-(4-nitrophenyl)prop-2-enamido]benzamido}benzoic acid
Compound characteristics
| Compound ID: | 3289-8911 |
| Compound Name: | 3-{2-[3-(4-nitrophenyl)prop-2-enamido]benzamido}benzoic acid |
| Molecular Weight: | 431.4 |
| Molecular Formula: | C23 H17 N3 O6 |
| Smiles: | C(=C/c1ccc(cc1)[N+]([O-])=O)\C(Nc1ccccc1C(Nc1cccc(c1)C(O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6074 |
| logD: | 1.7216 |
| logSw: | -4.4351 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 107.299 |
| InChI Key: | WLPLEDVOMDQIKN-UHFFFAOYSA-N |