5-{[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-(4-methoxyphenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
5-{[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-(4-methoxyphenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
5-{[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-(4-methoxyphenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
Compound ID: | L984-0249 |
Compound Name: | 5-{[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl}-1-(4-methoxyphenyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
Molecular Weight: | 474.48 |
Molecular Formula: | C24 H22 N6 O5 |
Smiles: | CCOc1ccc(cc1OC)c1nc(CN2C=Nc3c(cnn3c3ccc(cc3)OC)C2=O)on1 |
Stereo: | ACHIRAL |
logP: | 3.5712 |
logD: | 3.5712 |
logSw: | -3.573 |
Hydrogen bond acceptors count: | 10 |
Polar surface area: | 94.017 |
InChI Key: | KRPNQCGTUOLUPB-UHFFFAOYSA-N |