ethyl [2-(2,5-dimethoxybenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetate
Chemical Structure Depiction of
ethyl [2-(2,5-dimethoxybenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetate
ethyl [2-(2,5-dimethoxybenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetate
Compound characteristics
| Compound ID: | E730-1969 |
| Compound Name: | ethyl [2-(2,5-dimethoxybenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetate |
| Molecular Weight: | 419.5 |
| Molecular Formula: | C21 H25 N O6 S |
| Smiles: | CCOC(CC1c2ccccc2CCN1S(c1cc(ccc1OC)OC)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5517 |
| logD: | 3.5517 |
| logSw: | -3.6972 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.258 |
| InChI Key: | QSBBNCCSWLGUIF-SFHVURJKSA-N |