4-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]-N-(3,4,5-trimethoxyphenyl)butanamide
Chemical Structure Depiction of
4-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]-N-(3,4,5-trimethoxyphenyl)butanamide
4-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]-N-(3,4,5-trimethoxyphenyl)butanamide
Compound characteristics
| Compound ID: | C071-0647 |
| Compound Name: | 4-[4-(thiophen-2-yl)-6-(trifluoromethyl)pyrimidine-2-sulfonyl]-N-(3,4,5-trimethoxyphenyl)butanamide |
| Molecular Weight: | 545.56 |
| Molecular Formula: | C22 H22 F3 N3 O6 S2 |
| Smiles: | COc1cc(cc(c1OC)OC)NC(CCCS(c1nc(cc(C(F)(F)F)n1)c1cccs1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1039 |
| logD: | 3.0998 |
| logSw: | -3.5903 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.998 |
| InChI Key: | JGMSCQZXNAYWLF-UHFFFAOYSA-N |