methyl [2-(2,5-dimethoxybenzene-1-sulfonyl)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]acetate
Chemical Structure Depiction of
methyl [2-(2,5-dimethoxybenzene-1-sulfonyl)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]acetate
methyl [2-(2,5-dimethoxybenzene-1-sulfonyl)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]acetate
Compound characteristics
| Compound ID: | E540-0877 |
| Compound Name: | methyl [2-(2,5-dimethoxybenzene-1-sulfonyl)-6,7-diethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]acetate |
| Molecular Weight: | 493.58 |
| Molecular Formula: | C24 H31 N O8 S |
| Smiles: | CCOc1cc2CCN(C(CC(=O)OC)c2cc1OCC)S(c1cc(ccc1OC)OC)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4387 |
| logD: | 2.4387 |
| logSw: | -2.9906 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 82.098 |
| InChI Key: | HMDOWQUGHZAZGH-IBGZPJMESA-N |