4-butoxy-N-(4-{[4-methyl-6-(4-methylanilino)pyrimidin-2-yl]amino}phenyl)benzene-1-sulfonamide
Chemical Structure Depiction of
4-butoxy-N-(4-{[4-methyl-6-(4-methylanilino)pyrimidin-2-yl]amino}phenyl)benzene-1-sulfonamide
4-butoxy-N-(4-{[4-methyl-6-(4-methylanilino)pyrimidin-2-yl]amino}phenyl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | G869-1071 |
| Compound Name: | 4-butoxy-N-(4-{[4-methyl-6-(4-methylanilino)pyrimidin-2-yl]amino}phenyl)benzene-1-sulfonamide |
| Molecular Weight: | 517.65 |
| Molecular Formula: | C28 H31 N5 O3 S |
| Smiles: | CCCCOc1ccc(cc1)S(Nc1ccc(cc1)Nc1nc(C)cc(Nc2ccc(C)cc2)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 7.315 |
| logD: | 6.4652 |
| logSw: | -5.6181 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 86.21 |
| InChI Key: | IHLQDNJTVLFCMY-UHFFFAOYSA-N |