6,7-diethoxy-2-methyl-1-oxo-3-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid
Chemical Structure Depiction of
6,7-diethoxy-2-methyl-1-oxo-3-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid
6,7-diethoxy-2-methyl-1-oxo-3-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid
Compound characteristics
| Compound ID: | C066-1898 |
| Compound Name: | 6,7-diethoxy-2-methyl-1-oxo-3-(3,4,5-trimethoxyphenyl)-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid |
| Molecular Weight: | 459.5 |
| Molecular Formula: | C24 H29 N O8 |
| Smiles: | CCOc1cc2C(C(c3cc(c(c(c3)OC)OC)OC)N(C)C(c2cc1OCC)=O)C(O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 1.5371 |
| logD: | -1.1846 |
| logSw: | -1.8386 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.495 |
| InChI Key: | OBPGELYTFSMDSQ-UHFFFAOYSA-N |