2-(azepan-1-yl)-1-(3-{3-[2-(benzyloxy)ethyl]-1,2,4-oxadiazol-5-yl}pyrrolidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-(azepan-1-yl)-1-(3-{3-[2-(benzyloxy)ethyl]-1,2,4-oxadiazol-5-yl}pyrrolidin-1-yl)ethan-1-one
2-(azepan-1-yl)-1-(3-{3-[2-(benzyloxy)ethyl]-1,2,4-oxadiazol-5-yl}pyrrolidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | S615-0087 |
| Compound Name: | 2-(azepan-1-yl)-1-(3-{3-[2-(benzyloxy)ethyl]-1,2,4-oxadiazol-5-yl}pyrrolidin-1-yl)ethan-1-one |
| Molecular Weight: | 412.53 |
| Molecular Formula: | C23 H32 N4 O3 |
| Smiles: | C1CCCN(CC1)CC(N1CCC(C1)c1nc(CCOCc2ccccc2)no1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9602 |
| logD: | 1.9175 |
| logSw: | -2.9451 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.743 |
| InChI Key: | PNBLLYGMQVUPCV-HXUWFJFHSA-N |