N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[6-(thiomorpholin-4-yl)pyrimidin-4-yl]-1H-imidazole-4-carboxamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[6-(thiomorpholin-4-yl)pyrimidin-4-yl]-1H-imidazole-4-carboxamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[6-(thiomorpholin-4-yl)pyrimidin-4-yl]-1H-imidazole-4-carboxamide
Compound characteristics
| Compound ID: | P578-1931 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-1-[6-(thiomorpholin-4-yl)pyrimidin-4-yl]-1H-imidazole-4-carboxamide |
| Molecular Weight: | 424.48 |
| Molecular Formula: | C20 H20 N6 O3 S |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(c1cn(cn1)c1cc(ncn1)N1CCSCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1343 |
| logD: | 3.1285 |
| logSw: | -3.2307 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.195 |
| InChI Key: | VZCRANBYYVOJQW-UHFFFAOYSA-N |