ethyl [2-(2,4,6-trimethylbenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetate
Chemical Structure Depiction of
ethyl [2-(2,4,6-trimethylbenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetate
ethyl [2-(2,4,6-trimethylbenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetate
Compound characteristics
| Compound ID: | E730-1952 |
| Compound Name: | ethyl [2-(2,4,6-trimethylbenzene-1-sulfonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]acetate |
| Molecular Weight: | 401.52 |
| Molecular Formula: | C22 H27 N O4 S |
| Smiles: | CCOC(CC1c2ccccc2CCN1S(c1c(C)cc(C)cc1C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.0036 |
| logD: | 5.0036 |
| logSw: | -4.4945 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.083 |
| InChI Key: | CKQJHLUTPDISBL-FQEVSTJZSA-N |