3-(furan-2-yl)-1-(3-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}pyrrolidin-1-yl)prop-2-en-1-one
Chemical Structure Depiction of
3-(furan-2-yl)-1-(3-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}pyrrolidin-1-yl)prop-2-en-1-one
3-(furan-2-yl)-1-(3-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}pyrrolidin-1-yl)prop-2-en-1-one
Compound characteristics
| Compound ID: | S460-0762 |
| Compound Name: | 3-(furan-2-yl)-1-(3-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}pyrrolidin-1-yl)prop-2-en-1-one |
| Molecular Weight: | 368.39 |
| Molecular Formula: | C18 H20 N6 O3 |
| Smiles: | CC(C)c1nc(c2cn(C3CCN(C3)C(/C=C/c3ccco3)=O)nn2)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9982 |
| logD: | 1.9982 |
| logSw: | -1.9504 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 82.091 |
| InChI Key: | BYFUHVXFKFFOHZ-CYBMUJFWSA-N |