2-{[3-cyano-6-phenyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}acetamide
Chemical Structure Depiction of
2-{[3-cyano-6-phenyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}acetamide
2-{[3-cyano-6-phenyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}acetamide
Compound characteristics
| Compound ID: | 3715-0089 |
| Compound Name: | 2-{[3-cyano-6-phenyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}-N-{4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}acetamide |
| Molecular Weight: | 598.63 |
| Molecular Formula: | C27 H21 F3 N6 O3 S2 |
| Smiles: | Cc1cc(C)nc(NS(c2ccc(cc2)NC(CSc2c(C#N)c(cc(c3ccccc3)n2)C(F)(F)F)=O)(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.2078 |
| logD: | 4.7256 |
| logSw: | -5.0826 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 108.616 |
| InChI Key: | RTEDTUYJNQZWBG-UHFFFAOYSA-N |