N-[3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]-2-{1-[(1H-pyrrol-1-yl)methyl]cyclohexyl}acetamide
Chemical Structure Depiction of
N-[3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]-2-{1-[(1H-pyrrol-1-yl)methyl]cyclohexyl}acetamide
N-[3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]-2-{1-[(1H-pyrrol-1-yl)methyl]cyclohexyl}acetamide
Compound characteristics
| Compound ID: | Y042-2643 |
| Compound Name: | N-[3-(methylsulfanyl)-1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]-2-{1-[(1H-pyrrol-1-yl)methyl]cyclohexyl}acetamide |
| Molecular Weight: | 425.6 |
| Molecular Formula: | C23 H31 N5 O S |
| Smiles: | CSCCC(c1nnc2ccccn12)NC(CC1(CCCCC1)Cn1cccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7468 |
| logD: | 2.7467 |
| logSw: | -3.1068 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.682 |
| InChI Key: | PDJANJQNZNLMPO-IBGZPJMESA-N |