6-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-3-{[3-(trifluoromethyl)phenyl]methyl}-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Chemical Structure Depiction of
6-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-3-{[3-(trifluoromethyl)phenyl]methyl}-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
6-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-3-{[3-(trifluoromethyl)phenyl]methyl}-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | F830-0331 |
| Compound Name: | 6-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-3-{[3-(trifluoromethyl)phenyl]methyl}-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one |
| Molecular Weight: | 453.38 |
| Molecular Formula: | C21 H14 F3 N7 O2 |
| Smiles: | C(c1nc(c2ccccc2)no1)N1C=Nc2c(C1=O)nnn2Cc1cccc(c1)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 3.3093 |
| logD: | 3.3093 |
| logSw: | -3.6562 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 84.365 |
| InChI Key: | WKVUHYVIPVMULW-UHFFFAOYSA-N |