4-methyl-N-[3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)pentanamide
Chemical Structure Depiction of
4-methyl-N-[3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)pentanamide
4-methyl-N-[3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)pentanamide
Compound characteristics
| Compound ID: | IB07-1697 |
| Compound Name: | 4-methyl-N-[3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]-2-(1-oxo-1,3-dihydro-2H-isoindol-2-yl)pentanamide |
| Molecular Weight: | 451.59 |
| Molecular Formula: | C24 H29 N5 O2 S |
| Smiles: | CC(C)CC(C(NC(CCSC)c1nnc2ccccn12)=O)N1Cc2ccccc2C1=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.87 |
| logD: | 2.87 |
| logSw: | -4.43 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 124.91 |
| InChI Key: | XGZMAEMJBHJNTI-UHFFFAOYSA-N |