3-methyl-1-{4-[7-(5-methyl-1,2-oxazole-3-carbonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]piperidin-1-yl}butan-1-one
Chemical Structure Depiction of
3-methyl-1-{4-[7-(5-methyl-1,2-oxazole-3-carbonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]piperidin-1-yl}butan-1-one
3-methyl-1-{4-[7-(5-methyl-1,2-oxazole-3-carbonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]piperidin-1-yl}butan-1-one
Compound characteristics
| Compound ID: | S903-0135 |
| Compound Name: | 3-methyl-1-{4-[7-(5-methyl-1,2-oxazole-3-carbonyl)-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazin-3-yl]piperidin-1-yl}butan-1-one |
| Molecular Weight: | 400.48 |
| Molecular Formula: | C20 H28 N6 O3 |
| Smiles: | CC(C)CC(N1CCC(CC1)c1nnc2CN(CCn12)C(c1cc(C)on1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2285 |
| logD: | 1.2284 |
| logSw: | -1.572 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 78.942 |
| InChI Key: | CQLNROFXTFWRRV-UHFFFAOYSA-N |