N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[6-methyl-2-(3-methylpiperidin-1-yl)pyrimidin-4-yl]oxy}acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[6-methyl-2-(3-methylpiperidin-1-yl)pyrimidin-4-yl]oxy}acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[6-methyl-2-(3-methylpiperidin-1-yl)pyrimidin-4-yl]oxy}acetamide
Compound characteristics
Compound ID: | L868-0971 |
Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-{[6-methyl-2-(3-methylpiperidin-1-yl)pyrimidin-4-yl]oxy}acetamide |
Molecular Weight: | 398.46 |
Molecular Formula: | C21 H26 N4 O4 |
Smiles: | CC1CCCN(C1)c1nc(C)cc(n1)OCC(NCc1ccc2c(c1)OCO2)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.4759 |
logD: | 3.4758 |
logSw: | -3.5364 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 69.644 |
InChI Key: | LVAURCFPNQMYBX-AWEZNQCLSA-N |