N-{1-[6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{1-[6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl}-2H-1,3-benzodioxole-5-carboxamide
N-{1-[6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | S471-0509 |
| Compound Name: | N-{1-[6-(trifluoromethyl)pyrimidin-4-yl]piperidin-4-yl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 394.35 |
| Molecular Formula: | C18 H17 F3 N4 O3 |
| Smiles: | C1CN(CCC1NC(c1ccc2c(c1)OCO2)=O)c1cc(C(F)(F)F)ncn1 |
| Stereo: | ACHIRAL |
| logP: | 3.2685 |
| logD: | 3.2685 |
| logSw: | -3.4472 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.026 |
| InChI Key: | IYRCDCJMEYUBON-UHFFFAOYSA-N |