{4-[5-(hydroxymethyl)-2-methylpyrimidin-4-yl]piperidin-1-yl}(isoquinolin-1-yl)methanone
Chemical Structure Depiction of
{4-[5-(hydroxymethyl)-2-methylpyrimidin-4-yl]piperidin-1-yl}(isoquinolin-1-yl)methanone
{4-[5-(hydroxymethyl)-2-methylpyrimidin-4-yl]piperidin-1-yl}(isoquinolin-1-yl)methanone
Compound characteristics
| Compound ID: | SA02-0035 |
| Compound Name: | {4-[5-(hydroxymethyl)-2-methylpyrimidin-4-yl]piperidin-1-yl}(isoquinolin-1-yl)methanone |
| Molecular Weight: | 362.43 |
| Molecular Formula: | C21 H22 N4 O2 |
| Smiles: | Cc1ncc(CO)c(C2CCN(CC2)C(c2c3ccccc3ccn2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.8651 |
| logD: | 1.865 |
| logSw: | -2.2684 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.753 |
| InChI Key: | JYQYWSKWKMRDHJ-UHFFFAOYSA-N |