2'-(2-methoxyethyl)-1'-oxo-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxylic acid
Chemical Structure Depiction of
2'-(2-methoxyethyl)-1'-oxo-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxylic acid
2'-(2-methoxyethyl)-1'-oxo-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxylic acid
Compound characteristics
| Compound ID: | Y041-4841 |
| Compound Name: | 2'-(2-methoxyethyl)-1'-oxo-1',4'-dihydro-2'H-spiro[cyclohexane-1,3'-isoquinoline]-4'-carboxylic acid |
| Molecular Weight: | 317.38 |
| Molecular Formula: | C18 H23 N O4 |
| Smiles: | COCCN1C(c2ccccc2C(C(O)=O)C12CCCCC2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.149 |
| logD: | -0.5692 |
| logSw: | -2.631 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.63 |
| InChI Key: | DHWUKBUJFIQUNG-HNNXBMFYSA-N |