(3,4-dimethylphenyl)(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
(3,4-dimethylphenyl)(3-{4-[3-(propan-2-yl)-1,2,4-oxadiazol-5-yl]-1H-1,2,3-triazol-1-yl}pyrrolidin-1-yl)methanone
(3,4-dimethylphenyl)(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: | S460-0772 |
| Compound Name: | (3,4-dimethylphenyl)(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: | 380.45 |
| Molecular Formula: | C20 H24 N6 O2 |
| Smiles: | CC(C)c1nc(c2cn(C3CCN(C3)C(c3ccc(C)c(C)c3)=O)nn2)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0782 |
| logD: | 3.0782 |
| logSw: | -2.8178 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 74.87 |
| InChI Key: | VYTHRRWOXKZPLD-MRXNPFEDSA-N |