4-[4-(2,4-dinitroanilino)anilino]-4-oxobutanoic acid
Chemical Structure Depiction of
4-[4-(2,4-dinitroanilino)anilino]-4-oxobutanoic acid
4-[4-(2,4-dinitroanilino)anilino]-4-oxobutanoic acid
Compound characteristics
| Compound ID: | 1513-0625 |
| Compound Name: | 4-[4-(2,4-dinitroanilino)anilino]-4-oxobutanoic acid |
| Molecular Weight: | 374.31 |
| Molecular Formula: | C16 H14 N4 O7 |
| Smiles: | C(CC(Nc1ccc(cc1)Nc1ccc(cc1[N+]([O-])=O)[N+]([O-])=O)=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6584 |
| logD: | -0.291 |
| logSw: | -3.1365 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 126.448 |
| InChI Key: | LJTZVHCZFMSLJB-UHFFFAOYSA-N |