1-(2-hydroxyethyl)-6-{[(pyridin-3-yl)methyl]sulfanyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Chemical Structure Depiction of
1-(2-hydroxyethyl)-6-{[(pyridin-3-yl)methyl]sulfanyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
1-(2-hydroxyethyl)-6-{[(pyridin-3-yl)methyl]sulfanyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | F248-0108 |
| Compound Name: | 1-(2-hydroxyethyl)-6-{[(pyridin-3-yl)methyl]sulfanyl}-1,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one |
| Molecular Weight: | 303.34 |
| Molecular Formula: | C13 H13 N5 O2 S |
| Smiles: | C(CO)n1c2c(cn1)C(NC(=N2)SCc1cccnc1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.0534 |
| logD: | 0.0265 |
| logSw: | -1.8161 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.739 |
| InChI Key: | MAJFWQDBLCRCAT-UHFFFAOYSA-N |