3-(3-chlorophenyl)-6-({3-[3-(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-(3-chlorophenyl)-6-({3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
3-(3-chlorophenyl)-6-({3-[3-(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: | F830-0433 |
| Compound Name: | 3-(3-chlorophenyl)-6-({3-[3-(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: | 473.8 |
| Molecular Formula: | C20 H11 Cl F3 N7 O2 |
| Smiles: | C(c1nc(c2cccc(c2)C(F)(F)F)no1)N1C=Nc2c(C1=O)nnn2c1cccc(c1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.2011 |
| logD: | 4.2011 |
| logSw: | -4.5565 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 84.501 |
| InChI Key: | MBRDPMRWDNESQC-UHFFFAOYSA-N |