1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-methyl-4-(pyridin-4-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-methyl-4-(pyridin-4-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-methyl-4-(pyridin-4-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J094-0857 |
| Compound Name: | 1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-methyl-4-(pyridin-4-yl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 405.48 |
| Molecular Formula: | C21 H19 N5 O2 S |
| Smiles: | CCOc1ccc2c(c1)sc(n2)n1c2c(C(CC(N2)=O)c2ccncc2)c(C)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3069 |
| logD: | 3.2243 |
| logSw: | -3.4607 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.178 |
| InChI Key: | NXSUXXUPXWXLDV-HNNXBMFYSA-N |