3-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-6-fluoro-4-hydroxy-1-methylquinolin-2(1H)-one
Chemical Structure Depiction of
3-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-6-fluoro-4-hydroxy-1-methylquinolin-2(1H)-one
3-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-6-fluoro-4-hydroxy-1-methylquinolin-2(1H)-one
Compound characteristics
| Compound ID: | P680-0315 |
| Compound Name: | 3-[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]-6-fluoro-4-hydroxy-1-methylquinolin-2(1H)-one |
| Molecular Weight: | 416.2 |
| Molecular Formula: | C18 H11 Br F N3 O3 |
| Smiles: | CN1C(C(=C(c2cc(ccc12)F)O)c1nc(c2ccc(cc2)[Br])no1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9042 |
| logD: | 0.2076 |
| logSw: | -4.0391 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.855 |
| InChI Key: | DXJMCGYPYPWGSJ-UHFFFAOYSA-N |