1-{3-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}-2-(3-methylphenoxy)ethan-1-one
Chemical Structure Depiction of
1-{3-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}-2-(3-methylphenoxy)ethan-1-one
1-{3-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}-2-(3-methylphenoxy)ethan-1-one
Compound characteristics
| Compound ID: | S458-0087 |
| Compound Name: | 1-{3-[4-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}-2-(3-methylphenoxy)ethan-1-one |
| Molecular Weight: | 382.42 |
| Molecular Formula: | C19 H22 N6 O3 |
| Smiles: | Cc1cccc(c1)OCC(N1CCCC(C1)n1cc(c2nc(C)on2)nn1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6766 |
| logD: | 1.6766 |
| logSw: | -1.828 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 80.703 |
| InChI Key: | YZKCXWSRVSBIRP-HNNXBMFYSA-N |