1-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4-methylpiperidin-1-yl]-4-(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)butane-1,4-dione
Chemical Structure Depiction of
1-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4-methylpiperidin-1-yl]-4-(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)butane-1,4-dione
1-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4-methylpiperidin-1-yl]-4-(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)butane-1,4-dione
Compound characteristics
Compound ID: | S429-1150 |
Compound Name: | 1-[4-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-4-methylpiperidin-1-yl]-4-(3-oxo-3,4-dihydroquinoxalin-1(2H)-yl)butane-1,4-dione |
Molecular Weight: | 437.5 |
Molecular Formula: | C23 H27 N5 O4 |
Smiles: | CC1(CCN(CC1)C(CCC(N1CC(Nc2ccccc12)=O)=O)=O)c1nc(C2CC2)on1 |
Stereo: | ACHIRAL |
logP: | 2.1509 |
logD: | 2.1496 |
logSw: | -2.6607 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 88.179 |
InChI Key: | KHAJKFIMHFTRBR-UHFFFAOYSA-N |