1-tert-butyl-4-[1-(prop-2-yn-1-yl)-1H-benzimidazol-2-yl]pyrrolidin-2-one
Chemical Structure Depiction of
1-tert-butyl-4-[1-(prop-2-yn-1-yl)-1H-benzimidazol-2-yl]pyrrolidin-2-one
1-tert-butyl-4-[1-(prop-2-yn-1-yl)-1H-benzimidazol-2-yl]pyrrolidin-2-one
Compound characteristics
| Compound ID: | Y080-0735 |
| Compound Name: | 1-tert-butyl-4-[1-(prop-2-yn-1-yl)-1H-benzimidazol-2-yl]pyrrolidin-2-one |
| Molecular Weight: | 295.38 |
| Molecular Formula: | C18 H21 N3 O |
| Smiles: | CC(C)(C)N1CC(CC1=O)c1nc2ccccc2n1CC#C |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0674 |
| logD: | 3.0665 |
| logSw: | -2.9092 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 27.8622 |
| InChI Key: | ATJVWNJPBUHQMK-CYBMUJFWSA-N |