3-[4-(2H-1,3-benzodioxol-5-yl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]-N-(2-chloropyridin-3-yl)propanamide
Chemical Structure Depiction of
3-[4-(2H-1,3-benzodioxol-5-yl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]-N-(2-chloropyridin-3-yl)propanamide
3-[4-(2H-1,3-benzodioxol-5-yl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]-N-(2-chloropyridin-3-yl)propanamide
Compound characteristics
| Compound ID: | C071-0290 |
| Compound Name: | 3-[4-(2H-1,3-benzodioxol-5-yl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]-N-(2-chloropyridin-3-yl)propanamide |
| Molecular Weight: | 514.87 |
| Molecular Formula: | C20 H14 Cl F3 N4 O5 S |
| Smiles: | C(CS(c1nc(cc(C(F)(F)F)n1)c1ccc2c(c1)OCO2)(=O)=O)C(Nc1cccnc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.138 |
| logD: | 3.1376 |
| logSw: | -3.6401 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.105 |
| InChI Key: | KPSFQBMIWWLOBE-UHFFFAOYSA-N |