N-{[(4,6-dimethylpyrimidin-2-yl)amino][4-(pentyloxy)anilino]methylidene}-4-nitrobenzamide
Chemical Structure Depiction of
N-{[(4,6-dimethylpyrimidin-2-yl)amino][4-(pentyloxy)anilino]methylidene}-4-nitrobenzamide
N-{[(4,6-dimethylpyrimidin-2-yl)amino][4-(pentyloxy)anilino]methylidene}-4-nitrobenzamide
Compound characteristics
| Compound ID: | 4477-2379 |
| Compound Name: | N-{[(4,6-dimethylpyrimidin-2-yl)amino][4-(pentyloxy)anilino]methylidene}-4-nitrobenzamide |
| Molecular Weight: | 476.53 |
| Molecular Formula: | C25 H28 N6 O4 |
| Smiles: | CCCCCOc1ccc(cc1)N/C(Nc1nc(C)cc(C)n1)=N/C(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4947 |
| logD: | 4.5306 |
| logSw: | -5.1505 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.647 |
| InChI Key: | LXQTWWKABUUBTL-UHFFFAOYSA-N |