methyl N-[(3-oxo-2,3-dihydro-1H-isoindol-1-yl)acetyl]-beta-alaninate
Chemical Structure Depiction of
methyl N-[(3-oxo-2,3-dihydro-1H-isoindol-1-yl)acetyl]-beta-alaninate
methyl N-[(3-oxo-2,3-dihydro-1H-isoindol-1-yl)acetyl]-beta-alaninate
Compound characteristics
| Compound ID: | Y041-8994 |
| Compound Name: | methyl N-[(3-oxo-2,3-dihydro-1H-isoindol-1-yl)acetyl]-beta-alaninate |
| Molecular Weight: | 276.29 |
| Molecular Formula: | C14 H16 N2 O4 |
| Smiles: | COC(CCNC(CC1c2ccccc2C(N1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.1834 |
| logD: | -0.1835 |
| logSw: | -2.0832 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.192 |
| InChI Key: | FBJTVOFHPOJLCK-LLVKDONJSA-N |