3-(2,3-dimethoxyphenyl)-6,7-dimethoxy-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid
Chemical Structure Depiction of
3-(2,3-dimethoxyphenyl)-6,7-dimethoxy-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid
3-(2,3-dimethoxyphenyl)-6,7-dimethoxy-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid
Compound characteristics
| Compound ID: | C066-1678 |
| Compound Name: | 3-(2,3-dimethoxyphenyl)-6,7-dimethoxy-2-methyl-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid |
| Molecular Weight: | 401.41 |
| Molecular Formula: | C21 H23 N O7 |
| Smiles: | CN1C(C(C(O)=O)c2cc(c(cc2C1=O)OC)OC)c1cccc(c1OC)OC |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.3826 |
| logD: | -1.3391 |
| logSw: | -2.13 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.705 |
| InChI Key: | KKWULAXBLFUDOA-UHFFFAOYSA-N |