1-(3-chloro-2-methylphenyl)-3,6-dimethyl-N-[3-(methylsulfanyl)phenyl]-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
Chemical Structure Depiction of
1-(3-chloro-2-methylphenyl)-3,6-dimethyl-N-[3-(methylsulfanyl)phenyl]-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
1-(3-chloro-2-methylphenyl)-3,6-dimethyl-N-[3-(methylsulfanyl)phenyl]-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
Compound characteristics
| Compound ID: | E981-1002 |
| Compound Name: | 1-(3-chloro-2-methylphenyl)-3,6-dimethyl-N-[3-(methylsulfanyl)phenyl]-1H-pyrazolo[3,4-b]pyridine-4-carboxamide |
| Molecular Weight: | 436.96 |
| Molecular Formula: | C23 H21 Cl N4 O S |
| Smiles: | Cc1c(cccc1[Cl])n1c2c(c(cc(C)n2)C(Nc2cccc(c2)SC)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.3868 |
| logD: | 5.3866 |
| logSw: | -5.9868 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.231 |
| InChI Key: | VPSBXHYQTSXLRX-UHFFFAOYSA-N |