1-{4-[7-(1-ethyl-1H-pyrazole-3-carbonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]piperidin-1-yl}-3-methylbutan-1-one
Chemical Structure Depiction of
1-{4-[7-(1-ethyl-1H-pyrazole-3-carbonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]piperidin-1-yl}-3-methylbutan-1-one
1-{4-[7-(1-ethyl-1H-pyrazole-3-carbonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]piperidin-1-yl}-3-methylbutan-1-one
Compound characteristics
| Compound ID: | S903-1430 |
| Compound Name: | 1-{4-[7-(1-ethyl-1H-pyrazole-3-carbonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]piperidin-1-yl}-3-methylbutan-1-one |
| Molecular Weight: | 413.52 |
| Molecular Formula: | C21 H31 N7 O2 |
| Smiles: | CCn1ccc(C(N2CCn3c(C2)nnc3C2CCN(CC2)C(CC(C)C)=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 0.5951 |
| logD: | 0.595 |
| logSw: | -1.5249 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 72.099 |
| InChI Key: | YEKBCTQNROWARH-UHFFFAOYSA-N |