N-(4-{[6-methyl-2-(4-methylanilino)pyrimidin-4-yl]amino}phenyl)thiophene-2-sulfonamide
Chemical Structure Depiction of
N-(4-{[6-methyl-2-(4-methylanilino)pyrimidin-4-yl]amino}phenyl)thiophene-2-sulfonamide
N-(4-{[6-methyl-2-(4-methylanilino)pyrimidin-4-yl]amino}phenyl)thiophene-2-sulfonamide
Compound characteristics
| Compound ID: | D578-0168 |
| Compound Name: | N-(4-{[6-methyl-2-(4-methylanilino)pyrimidin-4-yl]amino}phenyl)thiophene-2-sulfonamide |
| Molecular Weight: | 451.57 |
| Molecular Formula: | C22 H21 N5 O2 S2 |
| Smiles: | Cc1ccc(cc1)Nc1nc(C)cc(Nc2ccc(cc2)NS(c2cccs2)(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.6457 |
| logD: | 4.7959 |
| logSw: | -5.5006 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.81 |
| InChI Key: | SHPJPLQBMYKNBW-UHFFFAOYSA-N |