3-[3,5-dimethyl-1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-1H-pyrazol-4-yl]-N-[3-(methylsulfanyl)phenyl]propanamide
Chemical Structure Depiction of
3-[3,5-dimethyl-1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-1H-pyrazol-4-yl]-N-[3-(methylsulfanyl)phenyl]propanamide
3-[3,5-dimethyl-1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-1H-pyrazol-4-yl]-N-[3-(methylsulfanyl)phenyl]propanamide
Compound characteristics
| Compound ID: | G827-0188 |
| Compound Name: | 3-[3,5-dimethyl-1-(3-methyl[1,2,4]triazolo[4,3-b]pyridazin-6-yl)-1H-pyrazol-4-yl]-N-[3-(methylsulfanyl)phenyl]propanamide |
| Molecular Weight: | 421.52 |
| Molecular Formula: | C21 H23 N7 O S |
| Smiles: | Cc1c(CCC(Nc2cccc(c2)SC)=O)c(C)n(c2ccc3nnc(C)n3n2)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.1896 |
| logD: | 2.1895 |
| logSw: | -2.8773 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.205 |
| InChI Key: | MPEWBEZMGOWBJB-UHFFFAOYSA-N |