1-(2-methoxyphenyl)-6-{[(3-methylphenyl)methyl]sulfanyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
1-(2-methoxyphenyl)-6-{[(3-methylphenyl)methyl]sulfanyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
1-(2-methoxyphenyl)-6-{[(3-methylphenyl)methyl]sulfanyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | G873-0257 |
| Compound Name: | 1-(2-methoxyphenyl)-6-{[(3-methylphenyl)methyl]sulfanyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
| Molecular Weight: | 378.45 |
| Molecular Formula: | C20 H18 N4 O2 S |
| Smiles: | Cc1cccc(CSC2NC(c3cnn(c4ccccc4OC)c3N=2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.161 |
| logD: | 4.1222 |
| logSw: | -4.2188 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.781 |
| InChI Key: | XEFGVCVVKLZSRK-UHFFFAOYSA-N |