ethyl N-[2-(3-fluorophenyl)pyrrolidine-1-carbonyl]-beta-alaninate
Chemical Structure Depiction of
ethyl N-[2-(3-fluorophenyl)pyrrolidine-1-carbonyl]-beta-alaninate
ethyl N-[2-(3-fluorophenyl)pyrrolidine-1-carbonyl]-beta-alaninate
Compound characteristics
Compound ID: | D399-3570 |
Compound Name: | ethyl N-[2-(3-fluorophenyl)pyrrolidine-1-carbonyl]-beta-alaninate |
Molecular Weight: | 308.35 |
Molecular Formula: | C16 H21 F N2 O3 |
Smiles: | CCOC(CCNC(N1CCCC1c1cccc(c1)F)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.4035 |
logD: | 2.4035 |
logSw: | -2.8345 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 47.09 |
InChI Key: | DPXPQVFETNZEIC-AWEZNQCLSA-N |