2-(3-chlorophenoxy)-1-(4-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}piperidin-1-yl)propan-1-one
Chemical Structure Depiction of
2-(3-chlorophenoxy)-1-(4-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}piperidin-1-yl)propan-1-one
2-(3-chlorophenoxy)-1-(4-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}piperidin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | S454-0482 |
| Compound Name: | 2-(3-chlorophenoxy)-1-(4-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}piperidin-1-yl)propan-1-one |
| Molecular Weight: | 444.92 |
| Molecular Formula: | C21 H25 Cl N6 O3 |
| Smiles: | CC(C)c1nc(c2cn(C3CCN(CC3)C(C(C)Oc3cccc(c3)[Cl])=O)nn2)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.845 |
| logD: | 3.845 |
| logSw: | -4.0884 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 81.359 |
| InChI Key: | CXSJLYNENTYIOU-AWEZNQCLSA-N |