4-bromo-N-{[(4,6-dimethylpyrimidin-2-yl)amino](4-propoxyanilino)methylidene}benzene-1-sulfonamide
Chemical Structure Depiction of
4-bromo-N-{[(4,6-dimethylpyrimidin-2-yl)amino](4-propoxyanilino)methylidene}benzene-1-sulfonamide
4-bromo-N-{[(4,6-dimethylpyrimidin-2-yl)amino](4-propoxyanilino)methylidene}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 6186-3104 |
| Compound Name: | 4-bromo-N-{[(4,6-dimethylpyrimidin-2-yl)amino](4-propoxyanilino)methylidene}benzene-1-sulfonamide |
| Molecular Weight: | 518.43 |
| Molecular Formula: | C22 H24 Br N5 O3 S |
| Smiles: | CCCOc1ccc(cc1)N\C(Nc1nc(C)cc(C)n1)=N/S(c1ccc(cc1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3576 |
| logD: | 5.3573 |
| logSw: | -5.4152 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.567 |
| InChI Key: | OAJBDUCEXXEGGL-UHFFFAOYSA-N |