6-(4-fluorophenyl)-3-{3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine
Chemical Structure Depiction of
6-(4-fluorophenyl)-3-{3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine
6-(4-fluorophenyl)-3-{3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine
Compound characteristics
| Compound ID: | S354-0229 |
| Compound Name: | 6-(4-fluorophenyl)-3-{3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine |
| Molecular Weight: | 447.35 |
| Molecular Formula: | C20 H13 F4 N5 O3 |
| Smiles: | C1C(c2ccc(cc2)F)OCc2c(c3nc(c4ccc(cc4)OC(F)(F)F)no3)nnn12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4828 |
| logD: | 4.4828 |
| logSw: | -4.6729 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 72.102 |
| InChI Key: | ZJVXVKGXTYNYJJ-INIZCTEOSA-N |