methyl {6,7-diethoxy-2-[(3-fluoro-4-methylphenyl)carbamoyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}acetate
Chemical Structure Depiction of
methyl {6,7-diethoxy-2-[(3-fluoro-4-methylphenyl)carbamoyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}acetate
methyl {6,7-diethoxy-2-[(3-fluoro-4-methylphenyl)carbamoyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}acetate
Compound characteristics
| Compound ID: | G525-0050 |
| Compound Name: | methyl {6,7-diethoxy-2-[(3-fluoro-4-methylphenyl)carbamoyl]-1,2,3,4-tetrahydroisoquinolin-1-yl}acetate |
| Molecular Weight: | 444.5 |
| Molecular Formula: | C24 H29 F N2 O5 |
| Smiles: | CCOc1cc2CCN(C(CC(=O)OC)c2cc1OCC)C(Nc1ccc(C)c(c1)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4765 |
| logD: | 3.4765 |
| logSw: | -3.5897 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.905 |
| InChI Key: | VUNCUSVEWOJJGR-FQEVSTJZSA-N |