6-(4-methoxyphenyl)-3-{3-[3-(trifluoromethyl)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-methoxyphenyl)-3-{3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine
6-(4-methoxyphenyl)-3-{3-[3-(trifluoromethyl)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: | S354-0357 |
| Compound Name: | 6-(4-methoxyphenyl)-3-{3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine |
| Molecular Weight: | 443.38 |
| Molecular Formula: | C21 H16 F3 N5 O3 |
| Smiles: | COc1ccc(cc1)C1Cn2c(CO1)c(c1nc(c3cccc(c3)C(F)(F)F)no1)nn2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0466 |
| logD: | 4.0466 |
| logSw: | -4.3648 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 73.709 |
| InChI Key: | SOTCOOPZFAWQDU-QGZVFWFLSA-N |