3-(5-{5-[(4-fluorophenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazol-1-yl)-1-(pyrrolidin-1-yl)propan-1-one
Chemical Structure Depiction of
3-(5-{5-[(4-fluorophenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazol-1-yl)-1-(pyrrolidin-1-yl)propan-1-one
3-(5-{5-[(4-fluorophenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazol-1-yl)-1-(pyrrolidin-1-yl)propan-1-one
Compound characteristics
| Compound ID: | L701-0156 |
| Compound Name: | 3-(5-{5-[(4-fluorophenoxy)methyl]-1,2,4-oxadiazol-3-yl}-1H-benzotriazol-1-yl)-1-(pyrrolidin-1-yl)propan-1-one |
| Molecular Weight: | 436.44 |
| Molecular Formula: | C22 H21 F N6 O3 |
| Smiles: | C1CCN(C1)C(CCn1c2ccc(cc2nn1)c1nc(COc2ccc(cc2)F)on1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.086 |
| logD: | 3.086 |
| logSw: | -3.2684 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 80.972 |
| InChI Key: | IKNBZJUSZFGUIF-UHFFFAOYSA-N |