ethyl 4-{[6,7-dimethoxy-2-(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]methoxy}benzoate
Chemical Structure Depiction of
ethyl 4-{[6,7-dimethoxy-2-(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]methoxy}benzoate
ethyl 4-{[6,7-dimethoxy-2-(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]methoxy}benzoate
Compound characteristics
| Compound ID: | K407-0565 |
| Compound Name: | ethyl 4-{[6,7-dimethoxy-2-(tricyclo[3.3.1.1~3,7~]decane-1-carbonyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]methoxy}benzoate |
| Molecular Weight: | 533.67 |
| Molecular Formula: | C32 H39 N O6 |
| Smiles: | CCOC(c1ccc(cc1)OCC1c2cc(c(cc2CCN1C(C12CC3CC(CC(C3)C2)C1)=O)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.4611 |
| logD: | 6.4611 |
| logSw: | -5.7209 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.361 |
| InChI Key: | DUMJHTRDRDWPAR-IALHBCRKSA-N |