N-(2H-1,3-benzodioxol-5-yl)-2-({6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl}oxy)acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-({6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl}oxy)acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-({6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl}oxy)acetamide
Compound characteristics
| Compound ID: | M180-0525 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-({6-methyl-2-[4-(trifluoromethyl)phenyl]pyrimidin-4-yl}oxy)acetamide |
| Molecular Weight: | 431.37 |
| Molecular Formula: | C21 H16 F3 N3 O4 |
| Smiles: | Cc1cc(nc(c2ccc(cc2)C(F)(F)F)n1)OCC(Nc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.26 |
| logD: | 5.2599 |
| logSw: | -5.1229 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.737 |
| InChI Key: | HQLWZANDMSYOHE-UHFFFAOYSA-N |