1-phenyl-5-{[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
1-phenyl-5-{[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
1-phenyl-5-{[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | L984-0026 |
| Compound Name: | 1-phenyl-5-{[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
| Molecular Weight: | 460.45 |
| Molecular Formula: | C23 H20 N6 O5 |
| Smiles: | COc1cc(cc(c1OC)OC)c1nc(CN2C=Nc3c(cnn3c3ccccc3)C2=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.9816 |
| logD: | 2.9816 |
| logSw: | -3.3238 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 94.61 |
| InChI Key: | BLDIGWQJCWDXRZ-UHFFFAOYSA-N |