1-(4-methoxyphenyl)-5-({3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
1-(4-methoxyphenyl)-5-({3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
1-(4-methoxyphenyl)-5-({3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | L984-0251 |
| Compound Name: | 1-(4-methoxyphenyl)-5-({3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
| Molecular Weight: | 484.39 |
| Molecular Formula: | C22 H15 F3 N6 O4 |
| Smiles: | COc1ccc(cc1)n1c2c(cn1)C(N(Cc1nc(c3ccc(cc3)OC(F)(F)F)no1)C=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7944 |
| logD: | 4.7944 |
| logSw: | -4.5329 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 85.113 |
| InChI Key: | XYNSKLUEDWZLMV-UHFFFAOYSA-N |