5-chloro-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}-2-[(propan-2-yl)sulfanyl]pyrimidine-4-carboxamide
Chemical Structure Depiction of
5-chloro-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}-2-[(propan-2-yl)sulfanyl]pyrimidine-4-carboxamide
5-chloro-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}-2-[(propan-2-yl)sulfanyl]pyrimidine-4-carboxamide
Compound characteristics
Compound ID: | D233-0735 |
Compound Name: | 5-chloro-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}-2-[(propan-2-yl)sulfanyl]pyrimidine-4-carboxamide |
Molecular Weight: | 493 |
Molecular Formula: | C20 H21 Cl N6 O3 S2 |
Smiles: | [H]N(C(c1c(cnc(n1)SC(C)C)[Cl])=O)c1ccc(cc1)S(Nc1nc(C)cc(C)n1)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.6595 |
logD: | 3.1773 |
logSw: | -3.9327 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 101.883 |
InChI Key: | MYPOHCZRMMVBNZ-UHFFFAOYSA-N |