N-(2H-1,3-benzodioxol-5-yl)-4-[6-methyl-2-(piperidin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-4-[6-methyl-2-(piperidin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-4-[6-methyl-2-(piperidin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide
Compound characteristics
| Compound ID: | D574-0210 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-4-[6-methyl-2-(piperidin-1-yl)pyrimidin-4-yl]piperazine-1-carboxamide |
| Molecular Weight: | 424.5 |
| Molecular Formula: | C22 H28 N6 O3 |
| Smiles: | Cc1cc(nc(n1)N1CCCCC1)N1CCN(CC1)C(Nc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0659 |
| logD: | 4.0336 |
| logSw: | -3.9687 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.304 |
| InChI Key: | DXQPJGWPUJSLOQ-UHFFFAOYSA-N |