3-[(3-{4-[(4-fluorophenoxy)methyl]-1H-1,2,3-triazol-1-yl}azetidin-1-yl)methyl]benzonitrile
Chemical Structure Depiction of
3-[(3-{4-[(4-fluorophenoxy)methyl]-1H-1,2,3-triazol-1-yl}azetidin-1-yl)methyl]benzonitrile
3-[(3-{4-[(4-fluorophenoxy)methyl]-1H-1,2,3-triazol-1-yl}azetidin-1-yl)methyl]benzonitrile
Compound characteristics
| Compound ID: | S727-0503 |
| Compound Name: | 3-[(3-{4-[(4-fluorophenoxy)methyl]-1H-1,2,3-triazol-1-yl}azetidin-1-yl)methyl]benzonitrile |
| Molecular Weight: | 363.39 |
| Molecular Formula: | C20 H18 F N5 O |
| Smiles: | C1C(CN1Cc1cccc(C#N)c1)n1cc(COc2ccc(cc2)F)nn1 |
| Stereo: | ACHIRAL |
| logP: | 2.2479 |
| logD: | 1.7128 |
| logSw: | -2.3242 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 54.954 |
| InChI Key: | UNDPGOFLDNWLPE-UHFFFAOYSA-N |