3-(1-tert-butyl-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide
Chemical Structure Depiction of
3-(1-tert-butyl-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide
3-(1-tert-butyl-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide
Compound characteristics
| Compound ID: | C999-0449 |
| Compound Name: | 3-(1-tert-butyl-3,4,6-trimethyl-1H-pyrazolo[3,4-b]pyridin-5-yl)-N-{2-[4-(methylsulfanyl)phenyl]ethyl}propanamide |
| Molecular Weight: | 438.63 |
| Molecular Formula: | C25 H34 N4 O S |
| Smiles: | Cc1c(CCC(NCCc2ccc(cc2)SC)=O)c(C)nc2c1c(C)nn2C(C)(C)C |
| Stereo: | ACHIRAL |
| logP: | 4.1759 |
| logD: | 4.1727 |
| logSw: | -4.4303 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.219 |
| InChI Key: | MYJAGVBGUFTBBN-UHFFFAOYSA-N |