3-(2-hydroxy-3-methoxyphenyl)-2-[(3-methoxyphenyl)methyl]-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid
Chemical Structure Depiction of
3-(2-hydroxy-3-methoxyphenyl)-2-[(3-methoxyphenyl)methyl]-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid
3-(2-hydroxy-3-methoxyphenyl)-2-[(3-methoxyphenyl)methyl]-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid
Compound characteristics
| Compound ID: | G107-0127 |
| Compound Name: | 3-(2-hydroxy-3-methoxyphenyl)-2-[(3-methoxyphenyl)methyl]-1-oxo-1,2,3,4-tetrahydroisoquinoline-4-carboxylic acid |
| Molecular Weight: | 433.46 |
| Molecular Formula: | C25 H23 N O6 |
| Smiles: | COc1cccc(CN2C(C(C(O)=O)c3ccccc3C2=O)c2cccc(c2O)OC)c1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.2441 |
| logD: | 0.5224 |
| logSw: | -3.5468 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.713 |
| InChI Key: | WQHZURMDYLRGJX-UHFFFAOYSA-N |