4-(1,5-dimethyl-1H-pyrazol-4-yl)-1-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
4-(1,5-dimethyl-1H-pyrazol-4-yl)-1-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
4-(1,5-dimethyl-1H-pyrazol-4-yl)-1-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J094-0514 |
| Compound Name: | 4-(1,5-dimethyl-1H-pyrazol-4-yl)-1-(6-methoxy-1,3-benzothiazol-2-yl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 408.48 |
| Molecular Formula: | C20 H20 N6 O2 S |
| Smiles: | Cc1c2C(CC(Nc2n(c2nc3ccc(cc3s2)OC)n1)=O)c1cnn(C)c1C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5445 |
| logD: | 2.4619 |
| logSw: | -2.9981 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.657 |
| InChI Key: | PVGBLLGNVUDXKV-CYBMUJFWSA-N |