4-[3-(1H-benzimidazol-2-yl)anilino]-4-oxobutanoic acid
Chemical Structure Depiction of
4-[3-(1H-benzimidazol-2-yl)anilino]-4-oxobutanoic acid
4-[3-(1H-benzimidazol-2-yl)anilino]-4-oxobutanoic acid
Compound characteristics
| Compound ID: | 2922-2386 |
| Compound Name: | 4-[3-(1H-benzimidazol-2-yl)anilino]-4-oxobutanoic acid |
| Molecular Weight: | 309.32 |
| Molecular Formula: | C17 H15 N3 O3 |
| Smiles: | C(CC(Nc1cccc(c1)c1nc2ccccc2[nH]1)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4619 |
| logD: | -0.4875 |
| logSw: | -2.8963 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 70.791 |
| InChI Key: | IRRYAOSWTIGJPW-UHFFFAOYSA-N |