4-(1-ethyl-3-methyl-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-ethyl-3-methyl-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-ethyl-3-methyl-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: | J094-0515 |
| Compound Name: | 4-(1-ethyl-3-methyl-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: | 422.51 |
| Molecular Formula: | C21 H22 N6 O2 S |
| Smiles: | CCn1cc(C2CC(Nc3c2c(C)nn3c2nc3ccc(cc3s2)OC)=O)c(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8702 |
| logD: | 2.7875 |
| logSw: | -3.2969 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.025 |
| InChI Key: | WTCDQOKFOBTIRP-CQSZACIVSA-N |