N-{1-[2-methyl-6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{1-[2-methyl-6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl}-2H-1,3-benzodioxole-5-carboxamide
N-{1-[2-methyl-6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | S471-0660 |
| Compound Name: | N-{1-[2-methyl-6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 408.38 |
| Molecular Formula: | C19 H19 F3 N4 O3 |
| Smiles: | Cc1nc(cc(n1)N1CCC(CC1)NC(c1ccc2c(c1)OCO2)=O)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 3.4841 |
| logD: | 3.484 |
| logSw: | -3.6803 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.4 |
| InChI Key: | SZALIQDVQLXFSU-UHFFFAOYSA-N |