5-(2-hydroxy-5-nitroanilino)-5-oxo-2-propylpentanoic acid
Chemical Structure Depiction of
5-(2-hydroxy-5-nitroanilino)-5-oxo-2-propylpentanoic acid
5-(2-hydroxy-5-nitroanilino)-5-oxo-2-propylpentanoic acid
Compound characteristics
| Compound ID: | 5612-0116 |
| Compound Name: | 5-(2-hydroxy-5-nitroanilino)-5-oxo-2-propylpentanoic acid |
| Molecular Weight: | 310.3 |
| Molecular Formula: | C14 H18 N2 O6 |
| Smiles: | CCCC(CCC(Nc1cc(ccc1O)[N+]([O-])=O)=O)C(O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7365 |
| logD: | -0.5933 |
| logSw: | -2.2543 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 101.028 |
| InChI Key: | WDKLVJMLWYWHQX-VIFPVBQESA-N |