methyl [2-(3-chlorobenzene-1-sulfonyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]acetate
Chemical Structure Depiction of
methyl [2-(3-chlorobenzene-1-sulfonyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]acetate
methyl [2-(3-chlorobenzene-1-sulfonyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]acetate
Compound characteristics
| Compound ID: | E540-0982 |
| Compound Name: | methyl [2-(3-chlorobenzene-1-sulfonyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]acetate |
| Molecular Weight: | 439.91 |
| Molecular Formula: | C20 H22 Cl N O6 S |
| Smiles: | COC(CC1c2cc(c(cc2CCN1S(c1cccc(c1)[Cl])(=O)=O)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8894 |
| logD: | 2.8894 |
| logSw: | -3.4375 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.764 |
| InChI Key: | RXPUCELCMXHRBN-KRWDZBQOSA-N |