methyl 4-[6,7-diethoxy-2-(4-methoxyphenyl)-3-oxo-1,2,3,4-tetrahydroisoquinolin-1-yl]benzoate
Chemical Structure Depiction of
methyl 4-[6,7-diethoxy-2-(4-methoxyphenyl)-3-oxo-1,2,3,4-tetrahydroisoquinolin-1-yl]benzoate
methyl 4-[6,7-diethoxy-2-(4-methoxyphenyl)-3-oxo-1,2,3,4-tetrahydroisoquinolin-1-yl]benzoate
Compound characteristics
| Compound ID: | D145-2422 |
| Compound Name: | methyl 4-[6,7-diethoxy-2-(4-methoxyphenyl)-3-oxo-1,2,3,4-tetrahydroisoquinolin-1-yl]benzoate |
| Molecular Weight: | 475.54 |
| Molecular Formula: | C28 H29 N O6 |
| Smiles: | CCOc1cc2CC(N(C(c3ccc(cc3)C(=O)OC)c2cc1OCC)c1ccc(cc1)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3458 |
| logD: | 4.3458 |
| logSw: | -4.4116 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.456 |
| InChI Key: | ZXQLLOFYJSIQPD-MHZLTWQESA-N |