2-[5,7-dimethyl-2-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-1-(piperidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-[5,7-dimethyl-2-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-1-(piperidin-1-yl)ethan-1-one
2-[5,7-dimethyl-2-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-1-(piperidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | D458-0335 |
| Compound Name: | 2-[5,7-dimethyl-2-(3-methylphenyl)[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]-1-(piperidin-1-yl)ethan-1-one |
| Molecular Weight: | 363.46 |
| Molecular Formula: | C21 H25 N5 O |
| Smiles: | Cc1cccc(c1)c1nc2nc(C)c(CC(N3CCCCC3)=O)c(C)n2n1 |
| Stereo: | ACHIRAL |
| logP: | 3.31 |
| logD: | 3.31 |
| logSw: | -3.5472 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.225 |
| InChI Key: | QBXXSMNGUDNCCG-UHFFFAOYSA-N |