ethyl N-{3-[5-methyl-1-(propan-2-yl)-1H-imidazol-2-yl]pyrrolidine-1-carbonyl}-beta-alaninate
Chemical Structure Depiction of
ethyl N-{3-[5-methyl-1-(propan-2-yl)-1H-imidazol-2-yl]pyrrolidine-1-carbonyl}-beta-alaninate
ethyl N-{3-[5-methyl-1-(propan-2-yl)-1H-imidazol-2-yl]pyrrolidine-1-carbonyl}-beta-alaninate
Compound characteristics
| Compound ID: | T158-0786 |
| Compound Name: | ethyl N-{3-[5-methyl-1-(propan-2-yl)-1H-imidazol-2-yl]pyrrolidine-1-carbonyl}-beta-alaninate |
| Molecular Weight: | 336.43 |
| Molecular Formula: | C17 H28 N4 O3 |
| Smiles: | CCOC(CCNC(N1CCC(C1)c1ncc(C)n1C(C)C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7573 |
| logD: | -0.2121 |
| logSw: | -1.9834 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.861 |
| InChI Key: | YWBTYXMJVYTNBJ-CQSZACIVSA-N |