1-(4-{4-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidine-1-carbonyl}piperidin-1-yl)ethan-1-one
Chemical Structure Depiction of
1-(4-{4-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidine-1-carbonyl}piperidin-1-yl)ethan-1-one
1-(4-{4-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidine-1-carbonyl}piperidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | S454-0895 |
| Compound Name: | 1-(4-{4-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidine-1-carbonyl}piperidin-1-yl)ethan-1-one |
| Molecular Weight: | 449.51 |
| Molecular Formula: | C23 H27 N7 O3 |
| Smiles: | CC(N1CCC(CC1)C(N1CCC(CC1)n1cc(c2nc(c3ccccc3)no2)nn1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2396 |
| logD: | 2.2396 |
| logSw: | -2.2743 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 91.686 |
| InChI Key: | HESUPDHOTHFTCU-UHFFFAOYSA-N |