1-(4-ethylphenyl)-5-({3-[4-(methylsulfanyl)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-ethylphenyl)-5-({3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
1-(4-ethylphenyl)-5-({3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | L984-0307 |
| Compound Name: | 1-(4-ethylphenyl)-5-({3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
| Molecular Weight: | 444.51 |
| Molecular Formula: | C23 H20 N6 O2 S |
| Smiles: | CCc1ccc(cc1)n1c2c(cn1)C(N(Cc1nc(c3ccc(cc3)SC)no1)C=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2707 |
| logD: | 5.2707 |
| logSw: | -5.046 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 71.632 |
| InChI Key: | OEVDTSHTAUNHDW-UHFFFAOYSA-N |