3-oxo-2-(2-phenylethyl)-2,3-dihydro-1H-isoindole-4-carboxylic acid
Chemical Structure Depiction of
3-oxo-2-(2-phenylethyl)-2,3-dihydro-1H-isoindole-4-carboxylic acid
3-oxo-2-(2-phenylethyl)-2,3-dihydro-1H-isoindole-4-carboxylic acid
Compound characteristics
| Compound ID: | 8020-7911 |
| Compound Name: | 3-oxo-2-(2-phenylethyl)-2,3-dihydro-1H-isoindole-4-carboxylic acid |
| Molecular Weight: | 281.31 |
| Molecular Formula: | C17 H15 N O3 |
| Smiles: | C(CN1Cc2cccc(C(O)=O)c2C1=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.767 |
| logD: | -1.033 |
| logSw: | -3.0975 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.271 |
| InChI Key: | HBUKVBROECOTSV-UHFFFAOYSA-N |