1-(1,3-benzothiazol-2-yl)-4-(2,3,4-trimethoxyphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Chemical Structure Depiction of
1-(1,3-benzothiazol-2-yl)-4-(2,3,4-trimethoxyphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
1-(1,3-benzothiazol-2-yl)-4-(2,3,4-trimethoxyphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one
Compound characteristics
| Compound ID: | J081-0053 |
| Compound Name: | 1-(1,3-benzothiazol-2-yl)-4-(2,3,4-trimethoxyphenyl)-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-b]pyridin-6-one |
| Molecular Weight: | 436.49 |
| Molecular Formula: | C22 H20 N4 O4 S |
| Smiles: | COc1ccc(C2CC(Nc3c2cnn3c2nc3ccccc3s2)=O)c(c1OC)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0502 |
| logD: | 4.0501 |
| logSw: | -4.1181 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.338 |
| InChI Key: | ZJORKZIPJJCADY-ZDUSSCGKSA-N |