1-{4-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-4-(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)butane-1,4-dione
Chemical Structure Depiction of
1-{4-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-4-(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)butane-1,4-dione
1-{4-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-4-(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)butane-1,4-dione
Compound characteristics
Compound ID: | S428-0982 |
Compound Name: | 1-{4-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}-4-(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)butane-1,4-dione |
Molecular Weight: | 467.52 |
Molecular Formula: | C24 H29 N5 O5 |
Smiles: | C1CN(CCC1c1nc(C2CCOCC2)no1)C(CCC(N1CC(Nc2ccccc12)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 1.7176 |
logD: | 1.7162 |
logSw: | -2.2676 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 95.756 |
InChI Key: | QDNQTOWGISKHBX-UHFFFAOYSA-N |