methyl 4-{6,7-diethoxy-3-oxo-2-[4-(propan-2-yl)phenyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}benzoate
Chemical Structure Depiction of
methyl 4-{6,7-diethoxy-3-oxo-2-[4-(propan-2-yl)phenyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}benzoate
methyl 4-{6,7-diethoxy-3-oxo-2-[4-(propan-2-yl)phenyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}benzoate
Compound characteristics
| Compound ID: | D145-2437 |
| Compound Name: | methyl 4-{6,7-diethoxy-3-oxo-2-[4-(propan-2-yl)phenyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}benzoate |
| Molecular Weight: | 487.6 |
| Molecular Formula: | C30 H33 N O5 |
| Smiles: | CCOc1cc2CC(N(C(c3ccc(cc3)C(=O)OC)c2cc1OCC)c1ccc(cc1)C(C)C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.7017 |
| logD: | 5.7017 |
| logSw: | -5.465 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.912 |
| InChI Key: | FTSFQFGAHPEESM-LJAQVGFWSA-N |