5-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-(4-fluorophenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
5-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-(4-fluorophenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
5-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-(4-fluorophenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | L984-0061 |
| Compound Name: | 5-{[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-(4-fluorophenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
| Molecular Weight: | 448.41 |
| Molecular Formula: | C22 H17 F N6 O4 |
| Smiles: | COc1ccc(cc1OC)c1nc(CN2C=Nc3c(cnn3c3ccc(cc3)F)C2=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.2723 |
| logD: | 3.2723 |
| logSw: | -3.2801 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 86.893 |
| InChI Key: | DQJOZLDGDBDUJT-UHFFFAOYSA-N |