(3,4-dimethoxyphenyl)(4-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}piperidin-1-yl)methanone
Chemical Structure Depiction of
(3,4-dimethoxyphenyl)(4-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}piperidin-1-yl)methanone
(3,4-dimethoxyphenyl)(4-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}piperidin-1-yl)methanone
Compound characteristics
| Compound ID: | S454-0427 |
| Compound Name: | (3,4-dimethoxyphenyl)(4-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}piperidin-1-yl)methanone |
| Molecular Weight: | 426.47 |
| Molecular Formula: | C21 H26 N6 O4 |
| Smiles: | CC(C)c1nc(c2cn(C3CCN(CC3)C(c3ccc(c(c3)OC)OC)=O)nn2)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.2148 |
| logD: | 2.2148 |
| logSw: | -2.531 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 89.831 |
| InChI Key: | PYTIHAVBNFYZJL-UHFFFAOYSA-N |