2-(3-chlorophenyl)-1-{4-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(3-chlorophenyl)-1-{4-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}ethan-1-one
2-(3-chlorophenyl)-1-{4-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | S454-0319 |
| Compound Name: | 2-(3-chlorophenyl)-1-{4-[4-(3-ethyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}ethan-1-one |
| Molecular Weight: | 400.87 |
| Molecular Formula: | C19 H21 Cl N6 O2 |
| Smiles: | CCc1nc(c2cn(C3CCN(CC3)C(Cc3cccc(c3)[Cl])=O)nn2)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.104 |
| logD: | 3.104 |
| logSw: | -3.2477 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 75.033 |
| InChI Key: | XRRSXWPQESLXLR-UHFFFAOYSA-N |