3-fluoro-4-(3-{1-[3-oxo-3-(pyrrolidin-1-yl)propyl]-1H-benzotriazol-5-yl}-1,2,4-oxadiazol-5-yl)benzonitrile
Chemical Structure Depiction of
3-fluoro-4-(3-{1-[3-oxo-3-(pyrrolidin-1-yl)propyl]-1H-benzotriazol-5-yl}-1,2,4-oxadiazol-5-yl)benzonitrile
3-fluoro-4-(3-{1-[3-oxo-3-(pyrrolidin-1-yl)propyl]-1H-benzotriazol-5-yl}-1,2,4-oxadiazol-5-yl)benzonitrile
Compound characteristics
| Compound ID: | L701-0163 |
| Compound Name: | 3-fluoro-4-(3-{1-[3-oxo-3-(pyrrolidin-1-yl)propyl]-1H-benzotriazol-5-yl}-1,2,4-oxadiazol-5-yl)benzonitrile |
| Molecular Weight: | 431.43 |
| Molecular Formula: | C22 H18 F N7 O2 |
| Smiles: | C1CCN(C1)C(CCn1c2ccc(cc2nn1)c1nc(c2ccc(C#N)cc2F)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1699 |
| logD: | 3.1699 |
| logSw: | -3.4009 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 90.863 |
| InChI Key: | HYPIJGVCVOZVEH-UHFFFAOYSA-N |