3-(2-{4-[5-(hydroxymethyl)-2-methylpyrimidin-4-yl]piperidin-1-yl}-2-oxoethyl)-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-(2-{4-[5-(hydroxymethyl)-2-methylpyrimidin-4-yl]piperidin-1-yl}-2-oxoethyl)-1,3-benzoxazol-2(3H)-one
3-(2-{4-[5-(hydroxymethyl)-2-methylpyrimidin-4-yl]piperidin-1-yl}-2-oxoethyl)-1,3-benzoxazol-2(3H)-one
Compound characteristics
Compound ID: | SA02-0072 |
Compound Name: | 3-(2-{4-[5-(hydroxymethyl)-2-methylpyrimidin-4-yl]piperidin-1-yl}-2-oxoethyl)-1,3-benzoxazol-2(3H)-one |
Molecular Weight: | 382.42 |
Molecular Formula: | C20 H22 N4 O4 |
Smiles: | Cc1ncc(CO)c(C2CCN(CC2)C(CN2C(=O)Oc3ccccc23)=O)n1 |
Stereo: | ACHIRAL |
logP: | 0.9934 |
logD: | 0.9933 |
logSw: | -1.6368 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 75.779 |
InChI Key: | QRJAHSVPCJCDMG-UHFFFAOYSA-N |