4-{3-(4-carboxybenzamido)-5-[(4-nitrophenyl)carbamoyl]benzamido}benzoic acid
Chemical Structure Depiction of
4-{3-(4-carboxybenzamido)-5-[(4-nitrophenyl)carbamoyl]benzamido}benzoic acid
4-{3-(4-carboxybenzamido)-5-[(4-nitrophenyl)carbamoyl]benzamido}benzoic acid
Compound characteristics
| Compound ID: | 3289-0094 |
| Compound Name: | 4-{3-(4-carboxybenzamido)-5-[(4-nitrophenyl)carbamoyl]benzamido}benzoic acid |
| Molecular Weight: | 568.5 |
| Molecular Formula: | C29 H20 N4 O9 |
| Smiles: | c1cc(ccc1C(O)=O)C(Nc1cc(cc(c1)C(Nc1ccc(cc1)[N+]([O-])=O)=O)C(Nc1ccc(cc1)C(O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3113 |
| logD: | 1.7045 |
| logSw: | -5.4863 |
| Hydrogen bond acceptors count: | 16 |
| Hydrogen bond donors count: | 5 |
| Polar surface area: | 159.71 |
| InChI Key: | HXZZZKRXDKLPLG-UHFFFAOYSA-N |