1-{4-[5-(hydroxymethyl)-2-methylpyrimidin-4-yl]piperidin-1-yl}-2-(3-methylphenyl)ethan-1-one
Chemical Structure Depiction of
1-{4-[5-(hydroxymethyl)-2-methylpyrimidin-4-yl]piperidin-1-yl}-2-(3-methylphenyl)ethan-1-one
1-{4-[5-(hydroxymethyl)-2-methylpyrimidin-4-yl]piperidin-1-yl}-2-(3-methylphenyl)ethan-1-one
Compound characteristics
| Compound ID: | SA02-0100 |
| Compound Name: | 1-{4-[5-(hydroxymethyl)-2-methylpyrimidin-4-yl]piperidin-1-yl}-2-(3-methylphenyl)ethan-1-one |
| Molecular Weight: | 339.44 |
| Molecular Formula: | C20 H25 N3 O2 |
| Smiles: | Cc1cccc(CC(N2CCC(CC2)c2c(CO)cnc(C)n2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.5339 |
| logD: | 2.5339 |
| logSw: | -2.3208 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.679 |
| InChI Key: | SMXPIAHGQBQCPU-UHFFFAOYSA-N |