6-{[(2,5-dimethylphenyl)methyl]sulfanyl}-1-(2-hydroxyethyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
6-{[(2,5-dimethylphenyl)methyl]sulfanyl}-1-(2-hydroxyethyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
6-{[(2,5-dimethylphenyl)methyl]sulfanyl}-1-(2-hydroxyethyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | F248-0100 |
| Compound Name: | 6-{[(2,5-dimethylphenyl)methyl]sulfanyl}-1-(2-hydroxyethyl)-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
| Molecular Weight: | 330.41 |
| Molecular Formula: | C16 H18 N4 O2 S |
| Smiles: | Cc1ccc(C)c(CSC2NC(c3cnn(CCO)c3N=2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 2.5706 |
| logD: | 2.5517 |
| logSw: | -2.8212 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.221 |
| InChI Key: | GIOIQSJWGOFIED-UHFFFAOYSA-N |