3-(4-ethylphenyl)-6,7-dimethoxy-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid
Chemical Structure Depiction of
3-(4-ethylphenyl)-6,7-dimethoxy-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid
3-(4-ethylphenyl)-6,7-dimethoxy-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid
Compound characteristics
| Compound ID: | C066-1830 |
| Compound Name: | 3-(4-ethylphenyl)-6,7-dimethoxy-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid |
| Molecular Weight: | 369.42 |
| Molecular Formula: | C21 H23 N O5 |
| Smiles: | CCc1ccc(cc1)C1C(C(O)=O)c2cc(c(cc2C(N1C)=O)OC)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.484 |
| logD: | -0.2377 |
| logSw: | -2.7188 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.357 |
| InChI Key: | VDRQEGUIDDYMLK-UHFFFAOYSA-N |