5-(3,4-difluorophenyl)-6-({[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
5-(3,4-difluorophenyl)-6-({[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
5-(3,4-difluorophenyl)-6-({[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | L944-0619 |
| Compound Name: | 5-(3,4-difluorophenyl)-6-({[3-(thiophen-2-yl)-1,2,4-oxadiazol-5-yl]methyl}sulfanyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
| Molecular Weight: | 444.44 |
| Molecular Formula: | C18 H10 F2 N6 O2 S2 |
| Smiles: | C(c1nc(c2cccs2)no1)SC1=Nc2c(cn[nH]2)C(N1c1ccc(c(c1)F)F)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7838 |
| logD: | 3.7822 |
| logSw: | -3.8894 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.788 |
| InChI Key: | KYXHFWMOFNYMHS-UHFFFAOYSA-N |