1-{4-[4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}-2-(4-fluorophenoxy)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-(4-fluorophenoxy)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-(4-fluorophenoxy)ethan-1-one
Compound characteristics
| Compound ID: | S454-0713 |
| Compound Name: | 1-{4-[4-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-1H-1,2,3-triazol-1-yl]piperidin-1-yl}-2-(4-fluorophenoxy)ethan-1-one |
| Molecular Weight: | 412.42 |
| Molecular Formula: | C20 H21 F N6 O3 |
| Smiles: | C1CN(CCC1n1cc(c2nc(C3CC3)no2)nn1)C(COc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3339 |
| logD: | 2.3339 |
| logSw: | -2.3474 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 81.794 |
| InChI Key: | RRTWKIUYQJFIHE-UHFFFAOYSA-N |