(isoquinolin-1-yl)(3-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
(isoquinolin-1-yl)(3-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}pyrrolidin-1-yl)methanone
(isoquinolin-1-yl)(3-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | S460-0712 |
| Compound Name: | (isoquinolin-1-yl)(3-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}pyrrolidin-1-yl)methanone |
| Molecular Weight: | 403.44 |
| Molecular Formula: | C21 H21 N7 O2 |
| Smiles: | CC(C)c1nc(c2cn(C3CCN(C3)C(c3c4ccccc4ccn3)=O)nn2)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.479 |
| logD: | 2.479 |
| logSw: | -2.6622 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 84.416 |
| InChI Key: | BOVQCCZZWHTAEP-OAHLLOKOSA-N |