1-(3-chloro-2-methylphenyl)-3,6-dimethyl-N-[3-(propylsulfanyl)propyl]-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
Chemical Structure Depiction of
1-(3-chloro-2-methylphenyl)-3,6-dimethyl-N-[3-(propylsulfanyl)propyl]-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
1-(3-chloro-2-methylphenyl)-3,6-dimethyl-N-[3-(propylsulfanyl)propyl]-1H-pyrazolo[3,4-b]pyridine-4-carboxamide
Compound characteristics
| Compound ID: | E981-1098 |
| Compound Name: | 1-(3-chloro-2-methylphenyl)-3,6-dimethyl-N-[3-(propylsulfanyl)propyl]-1H-pyrazolo[3,4-b]pyridine-4-carboxamide |
| Molecular Weight: | 431 |
| Molecular Formula: | C22 H27 Cl N4 O S |
| Smiles: | CCCSCCCNC(c1cc(C)nc2c1c(C)nn2c1cccc(c1C)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.7977 |
| logD: | 4.7976 |
| logSw: | -4.8945 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.666 |
| InChI Key: | XIIVSLJLNMEWAX-UHFFFAOYSA-N |