N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]-1H-imidazole-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]-1H-imidazole-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]-1H-imidazole-4-carboxamide
Compound characteristics
| Compound ID: | P578-1123 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]-1H-imidazole-4-carboxamide |
| Molecular Weight: | 420.47 |
| Molecular Formula: | C22 H24 N6 O3 |
| Smiles: | CC1CCN(CC1)c1cc(ncn1)n1cc(C(NCc2ccc3c(c2)OCO3)=O)nc1 |
| Stereo: | ACHIRAL |
| logP: | 4.0398 |
| logD: | 4.0389 |
| logSw: | -3.9217 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.195 |
| InChI Key: | XOQNAQQNLUGGCB-UHFFFAOYSA-N |