2-(4-fluorophenyl)-1-{4-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(4-fluorophenyl)-1-{4-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}ethan-1-one
2-(4-fluorophenyl)-1-{4-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}ethan-1-one
Compound characteristics
Compound ID: | S454-0868 |
Compound Name: | 2-(4-fluorophenyl)-1-{4-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}ethan-1-one |
Molecular Weight: | 432.46 |
Molecular Formula: | C23 H21 F N6 O2 |
Smiles: | C1CN(CCC1n1cc(c2nc(c3ccccc3)no2)nn1)C(Cc1ccc(cc1)F)=O |
Stereo: | ACHIRAL |
logP: | 3.7796 |
logD: | 3.7796 |
logSw: | -3.9088 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 73.771 |
InChI Key: | RPPBBCSFOYIXNL-UHFFFAOYSA-N |