3-[(2-chlorophenyl)methyl]-6-({3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Chemical Structure Depiction of
3-[(2-chlorophenyl)methyl]-6-({3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
3-[(2-chlorophenyl)methyl]-6-({3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
Compound characteristics
| Compound ID: | F830-0074 |
| Compound Name: | 3-[(2-chlorophenyl)methyl]-6-({3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one |
| Molecular Weight: | 487.83 |
| Molecular Formula: | C21 H13 Cl F3 N7 O2 |
| Smiles: | C(c1nc(c2ccc(cc2)C(F)(F)F)no1)N1C=Nc2c(C1=O)nnn2Cc1ccccc1[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.1865 |
| logD: | 4.1865 |
| logSw: | -4.419 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 84.365 |
| InChI Key: | AXVSCKOEWBNYOO-UHFFFAOYSA-N |