1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-(3-methoxy-4-propoxyphenyl)-3-methyl-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)-4-(3-methoxy-4-propoxyphenyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-(3-methoxy-4-propoxyphenyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J081-2534 |
| Compound Name: | 1-(6-ethoxy-1,3-benzothiazol-2-yl)-4-(3-methoxy-4-propoxyphenyl)-3-methyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 492.6 |
| Molecular Formula: | C26 H28 N4 O4 S |
| Smiles: | CCCOc1ccc(cc1OC)C1CC(Nc2c1c(C)nn2c1nc2ccc(cc2s1)OCC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1861 |
| logD: | 5.1035 |
| logSw: | -5.0379 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.885 |
| InChI Key: | DYWCXLWOAFZCFZ-SFHVURJKSA-N |