3-[4-(2H-1,3-benzodioxol-5-yl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]-N-(3,4,5-trimethoxyphenyl)propanamide
Chemical Structure Depiction of
3-[4-(2H-1,3-benzodioxol-5-yl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]-N-(3,4,5-trimethoxyphenyl)propanamide
3-[4-(2H-1,3-benzodioxol-5-yl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]-N-(3,4,5-trimethoxyphenyl)propanamide
Compound characteristics
| Compound ID: | C071-0296 |
| Compound Name: | 3-[4-(2H-1,3-benzodioxol-5-yl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]-N-(3,4,5-trimethoxyphenyl)propanamide |
| Molecular Weight: | 569.51 |
| Molecular Formula: | C24 H22 F3 N3 O8 S |
| Smiles: | COc1cc(cc(c1OC)OC)NC(CCS(c1nc(cc(C(F)(F)F)n1)c1ccc2c(c1)OCO2)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2808 |
| logD: | 3.2804 |
| logSw: | -3.7422 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 110.095 |
| InChI Key: | KBJJFFURIOIYFN-UHFFFAOYSA-N |