3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-6-fluoro-1-methyl-7-(piperidin-1-yl)quinolin-4(1H)-one
Chemical Structure Depiction of
3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-6-fluoro-1-methyl-7-(piperidin-1-yl)quinolin-4(1H)-one
3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-6-fluoro-1-methyl-7-(piperidin-1-yl)quinolin-4(1H)-one
Compound characteristics
| Compound ID: | F418-0104 |
| Compound Name: | 3-[3-(2H-1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]-6-fluoro-1-methyl-7-(piperidin-1-yl)quinolin-4(1H)-one |
| Molecular Weight: | 448.45 |
| Molecular Formula: | C24 H21 F N4 O4 |
| Smiles: | CN1C=C(C(c2cc(c(cc12)N1CCCCC1)F)=O)c1nc(c2ccc3c(c2)OCO3)no1 |
| Stereo: | ACHIRAL |
| logP: | 4.0831 |
| logD: | 4.0831 |
| logSw: | -4.3114 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.222 |
| InChI Key: | XEXOMPRSJTWXRW-UHFFFAOYSA-N |