ethyl N-[2-(2-methylphenyl)pyrrolidine-1-carbonyl]-beta-alaninate
Chemical Structure Depiction of
ethyl N-[2-(2-methylphenyl)pyrrolidine-1-carbonyl]-beta-alaninate
ethyl N-[2-(2-methylphenyl)pyrrolidine-1-carbonyl]-beta-alaninate
Compound characteristics
| Compound ID: | D399-3138 |
| Compound Name: | ethyl N-[2-(2-methylphenyl)pyrrolidine-1-carbonyl]-beta-alaninate |
| Molecular Weight: | 304.39 |
| Molecular Formula: | C17 H24 N2 O3 |
| Smiles: | CCOC(CCNC(N1CCCC1c1ccccc1C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7698 |
| logD: | 2.7698 |
| logSw: | -2.8596 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.09 |
| InChI Key: | DBRMKBRHVVXTNS-HNNXBMFYSA-N |