1-{4-[3-(3-ethyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1,4-diazepan-1-yl}-2-(3-fluorophenyl)ethan-1-one
Chemical Structure Depiction of
1-{4-[3-(3-ethyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1,4-diazepan-1-yl}-2-(3-fluorophenyl)ethan-1-one
1-{4-[3-(3-ethyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1,4-diazepan-1-yl}-2-(3-fluorophenyl)ethan-1-one
Compound characteristics
| Compound ID: | P891-1512 |
| Compound Name: | 1-{4-[3-(3-ethyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]-1,4-diazepan-1-yl}-2-(3-fluorophenyl)ethan-1-one |
| Molecular Weight: | 409.46 |
| Molecular Formula: | C22 H24 F N5 O2 |
| Smiles: | CCc1nc(c2cccnc2N2CCCN(CC2)C(Cc2cccc(c2)F)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 3.5431 |
| logD: | 3.3173 |
| logSw: | -3.6371 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 61.599 |
| InChI Key: | QSQJYTHXHQOAID-UHFFFAOYSA-N |