5-(3-chloro-4-methoxyphenyl)-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-chloro-4-methoxyphenyl)-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-chloro-4-methoxyphenyl)-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: | L944-0470 |
| Compound Name: | 5-(3-chloro-4-methoxyphenyl)-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: | 472.93 |
| Molecular Formula: | C19 H13 Cl N6 O3 S2 |
| Smiles: | COc1ccc(cc1[Cl])N1C(=Nc2c(cn[nH]2)C1=O)SCc1nc(c2cccs2)no1 |
| Stereo: | ACHIRAL |
| logP: | 3.791 |
| logD: | 3.7894 |
| logSw: | -4.211 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.418 |
| InChI Key: | IPWAQMFKFBBHKQ-UHFFFAOYSA-N |