(3-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}pyrrolidin-1-yl)(1H-pyrrol-2-yl)methanone
Chemical Structure Depiction of
(3-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}pyrrolidin-1-yl)(1H-pyrrol-2-yl)methanone
(3-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}pyrrolidin-1-yl)(1H-pyrrol-2-yl)methanone
Compound characteristics
| Compound ID: | S460-0728 |
| Compound Name: | (3-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}pyrrolidin-1-yl)(1H-pyrrol-2-yl)methanone |
| Molecular Weight: | 341.37 |
| Molecular Formula: | C16 H19 N7 O2 |
| Smiles: | CC(C)c1nc(c2cn(C3CCN(C3)C(c3ccc[nH]3)=O)nn2)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.702 |
| logD: | 1.702 |
| logSw: | -1.9374 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.936 |
| InChI Key: | DQLYTPIHXQHZBQ-LLVKDONJSA-N |