1-ethyl-7-fluoro-4-hydroxy-3-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}quinolin-2(1H)-one
Chemical Structure Depiction of
1-ethyl-7-fluoro-4-hydroxy-3-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}quinolin-2(1H)-one
1-ethyl-7-fluoro-4-hydroxy-3-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}quinolin-2(1H)-one
Compound characteristics
| Compound ID: | P680-0644 |
| Compound Name: | 1-ethyl-7-fluoro-4-hydroxy-3-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}quinolin-2(1H)-one |
| Molecular Weight: | 397.43 |
| Molecular Formula: | C20 H16 F N3 O3 S |
| Smiles: | CCN1C(C(=C(c2ccc(cc12)F)O)c1nc(c2ccc(cc2)SC)no1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4362 |
| logD: | 0.8895 |
| logSw: | -4.3255 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.814 |
| InChI Key: | ISMQOJSTYNSBAQ-UHFFFAOYSA-N |