[2-(2,5-dimethoxybenzene-1-sulfonyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]acetic acid
Chemical Structure Depiction of
[2-(2,5-dimethoxybenzene-1-sulfonyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]acetic acid
[2-(2,5-dimethoxybenzene-1-sulfonyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]acetic acid
Compound characteristics
| Compound ID: | G536-1184 |
| Compound Name: | [2-(2,5-dimethoxybenzene-1-sulfonyl)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl]acetic acid |
| Molecular Weight: | 451.49 |
| Molecular Formula: | C21 H25 N O8 S |
| Smiles: | COc1ccc(c(c1)S(N1CCc2cc(c(cc2C1CC(O)=O)OC)OC)(=O)=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.4068 |
| logD: | -1.3942 |
| logSw: | -2.3159 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.744 |
| InChI Key: | YCQOKPZOHMROKT-INIZCTEOSA-N |