1-(1,3-benzothiazol-2-yl)-3-methyl-4-[4-(2-methylpropoxy)phenyl]-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1-(1,3-benzothiazol-2-yl)-3-methyl-4-[4-(2-methylpropoxy)phenyl]-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(1,3-benzothiazol-2-yl)-3-methyl-4-[4-(2-methylpropoxy)phenyl]-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J081-0233 |
| Compound Name: | 1-(1,3-benzothiazol-2-yl)-3-methyl-4-[4-(2-methylpropoxy)phenyl]-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 432.54 |
| Molecular Formula: | C24 H24 N4 O2 S |
| Smiles: | CC(C)COc1ccc(cc1)C1CC(Nc2c1c(C)nn2c1nc2ccccc2s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3029 |
| logD: | 5.3009 |
| logSw: | -5.3101 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.126 |
| InChI Key: | UWMZCLQYRXBTAX-SFHVURJKSA-N |