1-{4-[4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}-2-(3-methylphenoxy)ethan-1-one
Chemical Structure Depiction of
1-{4-[4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}-2-(3-methylphenoxy)ethan-1-one
1-{4-[4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}-2-(3-methylphenoxy)ethan-1-one
Compound characteristics
Compound ID: | S454-0743 |
Compound Name: | 1-{4-[4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}-2-(3-methylphenoxy)ethan-1-one |
Molecular Weight: | 408.46 |
Molecular Formula: | C21 H24 N6 O3 |
Smiles: | Cc1cccc(c1)OCC(N1CCC(CC1)n1cc(c2nc(C3CC3)no2)nn1)=O |
Stereo: | ACHIRAL |
logP: | 2.7961 |
logD: | 2.7961 |
logSw: | -2.821 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 81.794 |
InChI Key: | HFRYSEHYBCJNJB-UHFFFAOYSA-N |