N-{[(4,6-dimethylpyrimidin-2-yl)amino](4-methylanilino)methylidene}-4-nitrobenzamide
Chemical Structure Depiction of
N-{[(4,6-dimethylpyrimidin-2-yl)amino](4-methylanilino)methylidene}-4-nitrobenzamide
N-{[(4,6-dimethylpyrimidin-2-yl)amino](4-methylanilino)methylidene}-4-nitrobenzamide
Compound characteristics
| Compound ID: | 3391-6914 |
| Compound Name: | N-{[(4,6-dimethylpyrimidin-2-yl)amino](4-methylanilino)methylidene}-4-nitrobenzamide |
| Molecular Weight: | 404.43 |
| Molecular Formula: | C21 H20 N6 O3 |
| Smiles: | Cc1ccc(cc1)N\C(Nc1nc(C)cc(C)n1)=N/C(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9356 |
| logD: | 2.9715 |
| logSw: | -3.946 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.229 |
| InChI Key: | PGCABADNOGLOMS-UHFFFAOYSA-N |