1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-methyl-4-(4-propoxyphenyl)-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-(4-propoxyphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-methyl-4-(4-propoxyphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J081-2522 |
| Compound Name: | 1-(6-ethoxy-1,3-benzothiazol-2-yl)-3-methyl-4-(4-propoxyphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 462.57 |
| Molecular Formula: | C25 H26 N4 O3 S |
| Smiles: | CCCOc1ccc(cc1)C1CC(Nc2c1c(C)nn2c1nc2ccc(cc2s1)OCC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.424 |
| logD: | 5.3414 |
| logSw: | -5.3798 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.168 |
| InChI Key: | AHTYHFJKUYHXEL-IBGZPJMESA-N |