5-chloro-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}-2-(propylsulfanyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}-2-(propylsulfanyl)pyrimidine-4-carboxamide
5-chloro-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}-2-(propylsulfanyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D054-0476 |
| Compound Name: | 5-chloro-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}-2-(propylsulfanyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 493 |
| Molecular Formula: | C20 H21 Cl N6 O3 S2 |
| Smiles: | [H]N(C(c1c(cnc(n1)SCCC)[Cl])=O)c1ccc(cc1)S(Nc1nc(C)cc(C)n1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5887 |
| logD: | 3.1065 |
| logSw: | -3.7767 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 101.883 |
| InChI Key: | RBJWUWBWLDFBMS-UHFFFAOYSA-N |