3-[(3-fluorophenyl)methyl]-6-({3-[4-(methylsulfanyl)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-[(3-fluorophenyl)methyl]-6-({3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
3-[(3-fluorophenyl)methyl]-6-({3-[4-(methylsulfanyl)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: | F830-0207 |
| Compound Name: | 3-[(3-fluorophenyl)methyl]-6-({3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one |
| Molecular Weight: | 449.46 |
| Molecular Formula: | C21 H16 F N7 O2 S |
| Smiles: | CSc1ccc(cc1)c1nc(CN2C=Nc3c(C2=O)nnn3Cc2cccc(c2)F)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.499 |
| logD: | 3.499 |
| logSw: | -3.8698 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 84.365 |
| InChI Key: | GMOXAPFETATJSP-UHFFFAOYSA-N |