5-(azetidin-3-yl)-3-benzyl-1,2,4-oxadiazole--trifluoroacetic acid (1/1)
Chemical Structure Depiction of
5-(azetidin-3-yl)-3-benzyl-1,2,4-oxadiazole--trifluoroacetic acid (1/1)
5-(azetidin-3-yl)-3-benzyl-1,2,4-oxadiazole--trifluoroacetic acid (1/1)
Compound characteristics
| Compound ID: | S846-0006 |
| Compound Name: | 5-(azetidin-3-yl)-3-benzyl-1,2,4-oxadiazole--trifluoroacetic acid (1/1) |
| Molecular Weight: | 329.28 |
| Molecular Formula: | C12 H13 N3 O |
| Salt: | CF3COOH |
| Smiles: | C(c1ccccc1)c1nc(C2CNC2)on1 |
| Stereo: | ACHIRAL |
| logP: | 1.9029 |
| logD: | -2.1973 |
| logSw: | -2.0388 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.981 |
| InChI Key: | BZZLDQJGVRTDGB-UHFFFAOYSA-N |