3-(4-ethoxyphenyl)-6,7-dimethoxy-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid
Chemical Structure Depiction of
3-(4-ethoxyphenyl)-6,7-dimethoxy-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid
3-(4-ethoxyphenyl)-6,7-dimethoxy-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid
Compound characteristics
| Compound ID: | C066-1687 |
| Compound Name: | 3-(4-ethoxyphenyl)-6,7-dimethoxy-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid |
| Molecular Weight: | 385.42 |
| Molecular Formula: | C21 H23 N O6 |
| Smiles: | CCOc1ccc(cc1)C1C(C(O)=O)c2cc(c(cc2C(N1C)=O)OC)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.9223 |
| logD: | -0.7994 |
| logSw: | -2.6683 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.481 |
| InChI Key: | ZEYMXWFENONXNK-UHFFFAOYSA-N |