2-{[4-(2,4-dinitroanilino)phenyl]carbamoyl}benzoic acid
Chemical Structure Depiction of
2-{[4-(2,4-dinitroanilino)phenyl]carbamoyl}benzoic acid
2-{[4-(2,4-dinitroanilino)phenyl]carbamoyl}benzoic acid
Compound characteristics
| Compound ID: | 1513-0622 |
| Compound Name: | 2-{[4-(2,4-dinitroanilino)phenyl]carbamoyl}benzoic acid |
| Molecular Weight: | 422.35 |
| Molecular Formula: | C20 H14 N4 O7 |
| Smiles: | c1ccc(C(Nc2ccc(cc2)Nc2ccc(cc2[N+]([O-])=O)[N+]([O-])=O)=O)c(c1)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1438 |
| logD: | -0.299 |
| logSw: | -4.228 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 126.414 |
| InChI Key: | JVMFWXWCZOCSLZ-UHFFFAOYSA-N |