2-{2-methoxy-4-[1-(6-methoxy-1,3-benzothiazol-2-yl)-6-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl]phenoxy}acetamide
Chemical Structure Depiction of
2-{2-methoxy-4-[1-(6-methoxy-1,3-benzothiazol-2-yl)-6-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl]phenoxy}acetamide
2-{2-methoxy-4-[1-(6-methoxy-1,3-benzothiazol-2-yl)-6-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl]phenoxy}acetamide
Compound characteristics
| Compound ID: | J081-1605 |
| Compound Name: | 2-{2-methoxy-4-[1-(6-methoxy-1,3-benzothiazol-2-yl)-6-oxo-4,5,6,7-tetrahydro-1H-pyrazolo[3,4-b]pyridin-4-yl]phenoxy}acetamide |
| Molecular Weight: | 479.51 |
| Molecular Formula: | C23 H21 N5 O5 S |
| Smiles: | COc1ccc2c(c1)sc(n2)n1c2c(cn1)C(CC(N2)=O)c1ccc(c(c1)OC)OCC(N)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4418 |
| logD: | 2.4352 |
| logSw: | -3.1028 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 104.422 |
| InChI Key: | ORTQIWLTDMVGQC-AWEZNQCLSA-N |