methyl 4-{[6,7-dimethoxy-2-(3-phenylprop-2-enoyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]methoxy}benzoate
Chemical Structure Depiction of
methyl 4-{[6,7-dimethoxy-2-(3-phenylprop-2-enoyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]methoxy}benzoate
methyl 4-{[6,7-dimethoxy-2-(3-phenylprop-2-enoyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]methoxy}benzoate
Compound characteristics
| Compound ID: | K407-0509 |
| Compound Name: | methyl 4-{[6,7-dimethoxy-2-(3-phenylprop-2-enoyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]methoxy}benzoate |
| Molecular Weight: | 487.55 |
| Molecular Formula: | C29 H29 N O6 |
| Smiles: | COC(c1ccc(cc1)OCC1c2cc(c(cc2CCN1C(/C=C/c1ccccc1)=O)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7572 |
| logD: | 4.7572 |
| logSw: | -4.5536 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 59.22 |
| InChI Key: | QAXGBEUBFYMMRD-VWLOTQADSA-N |