4-[2-(2-chlorobenzamido)-3-(4-nitrophenyl)prop-2-enamido]benzoic acid
Chemical Structure Depiction of
4-[2-(2-chlorobenzamido)-3-(4-nitrophenyl)prop-2-enamido]benzoic acid
4-[2-(2-chlorobenzamido)-3-(4-nitrophenyl)prop-2-enamido]benzoic acid
Compound characteristics
| Compound ID: | 3379-2123 |
| Compound Name: | 4-[2-(2-chlorobenzamido)-3-(4-nitrophenyl)prop-2-enamido]benzoic acid |
| Molecular Weight: | 465.85 |
| Molecular Formula: | C23 H16 Cl N3 O6 |
| Smiles: | C(=C(/C(Nc1ccc(cc1)C(O)=O)=O)NC(c1ccccc1[Cl])=O)/c1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5043 |
| logD: | 2.109 |
| logSw: | -4.4147 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 107.044 |
| InChI Key: | SJFUSVKQHARMLA-UHFFFAOYSA-N |