N-{(3,4-dimethoxyanilino)[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-{(3,4-dimethoxyanilino)[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-4-methylbenzene-1-sulfonamide
N-{(3,4-dimethoxyanilino)[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y021-1896 |
| Compound Name: | N-{(3,4-dimethoxyanilino)[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 455.53 |
| Molecular Formula: | C22 H25 N5 O4 S |
| Smiles: | Cc1ccc(cc1)S(/N=C(/Nc1ccc(c(c1)OC)OC)Nc1nc(C)cc(C)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5226 |
| logD: | 3.5224 |
| logSw: | -3.7035 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 92.41 |
| InChI Key: | YAACFUKSVMMFCX-UHFFFAOYSA-N |