3-oxo-2-[(oxolan-2-yl)methyl]-2,3-dihydro-1H-isoindole-4-carboxylic acid
Chemical Structure Depiction of
3-oxo-2-[(oxolan-2-yl)methyl]-2,3-dihydro-1H-isoindole-4-carboxylic acid
3-oxo-2-[(oxolan-2-yl)methyl]-2,3-dihydro-1H-isoindole-4-carboxylic acid
Compound characteristics
| Compound ID: | 8020-7912 |
| Compound Name: | 3-oxo-2-[(oxolan-2-yl)methyl]-2,3-dihydro-1H-isoindole-4-carboxylic acid |
| Molecular Weight: | 261.27 |
| Molecular Formula: | C14 H15 N O4 |
| Smiles: | C1CC(CN2Cc3cccc(C(O)=O)c3C2=O)OC1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2051 |
| logD: | -2.5949 |
| logSw: | -2.1614 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.947 |
| InChI Key: | VCTPYRUECQNABJ-SNVBAGLBSA-N |