4-bromo-N-{(5-chloro-2-methoxyanilino)[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}benzene-1-sulfonamide
Chemical Structure Depiction of
4-bromo-N-{(5-chloro-2-methoxyanilino)[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}benzene-1-sulfonamide
4-bromo-N-{(5-chloro-2-methoxyanilino)[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | 5161-0070 |
| Compound Name: | 4-bromo-N-{(5-chloro-2-methoxyanilino)[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}benzene-1-sulfonamide |
| Molecular Weight: | 524.82 |
| Molecular Formula: | C20 H19 Br Cl N5 O3 S |
| Smiles: | Cc1cc(C)nc(NC(/Nc2cc(ccc2OC)[Cl])=N/S(c2ccc(cc2)[Br])(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.8861 |
| logD: | 4.8857 |
| logSw: | -4.8656 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 84.082 |
| InChI Key: | AMSIQVYFDAHLLG-UHFFFAOYSA-N |