3-(benzenesulfonyl)-1-{4-[5-(hydroxymethyl)-2-methylpyrimidin-4-yl]piperidin-1-yl}propan-1-one
Chemical Structure Depiction of
3-(benzenesulfonyl)-1-{4-[5-(hydroxymethyl)-2-methylpyrimidin-4-yl]piperidin-1-yl}propan-1-one
3-(benzenesulfonyl)-1-{4-[5-(hydroxymethyl)-2-methylpyrimidin-4-yl]piperidin-1-yl}propan-1-one
Compound characteristics
| Compound ID: | SA02-0003 |
| Compound Name: | 3-(benzenesulfonyl)-1-{4-[5-(hydroxymethyl)-2-methylpyrimidin-4-yl]piperidin-1-yl}propan-1-one |
| Molecular Weight: | 403.5 |
| Molecular Formula: | C20 H25 N3 O4 S |
| Smiles: | Cc1ncc(CO)c(C2CCN(CC2)C(CCS(c2ccccc2)(=O)=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 0.7189 |
| logD: | 0.7188 |
| logSw: | -1.9168 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.715 |
| InChI Key: | LUJFZBUIEIHLNB-UHFFFAOYSA-N |