1,3-dimethyl-4-{[(pyridin-2-yl)sulfanyl]methyl}-1,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1,3-dimethyl-4-{[(pyridin-2-yl)sulfanyl]methyl}-1,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one
1,3-dimethyl-4-{[(pyridin-2-yl)sulfanyl]methyl}-1,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | Y504-5492 |
| Compound Name: | 1,3-dimethyl-4-{[(pyridin-2-yl)sulfanyl]methyl}-1,7-dihydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 286.35 |
| Molecular Formula: | C14 H14 N4 O S |
| Smiles: | Cc1c2C(CSc3ccccn3)=CC(Nc2n(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.0427 |
| logD: | 1.041 |
| logSw: | -2.2636 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.922 |
| InChI Key: | XKOHICLKLSOQMI-UHFFFAOYSA-N |