ethyl 4-({2-[(2,6-diethylphenyl)carbamothioyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}methoxy)benzoate
Chemical Structure Depiction of
ethyl 4-({2-[(2,6-diethylphenyl)carbamothioyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}methoxy)benzoate
ethyl 4-({2-[(2,6-diethylphenyl)carbamothioyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}methoxy)benzoate
Compound characteristics
| Compound ID: | C111-0166 |
| Compound Name: | ethyl 4-({2-[(2,6-diethylphenyl)carbamothioyl]-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl}methoxy)benzoate |
| Molecular Weight: | 562.73 |
| Molecular Formula: | C32 H38 N2 O5 S |
| Smiles: | CCc1cccc(CC)c1NC(N1CCc2cc(c(cc2C1COc1ccc(cc1)C(=O)OCC)OC)OC)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.8202 |
| logD: | 6.8202 |
| logSw: | -5.6968 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.182 |
| InChI Key: | LWIRABBAPDEHLI-MHZLTWQESA-N |