7-{[6,7-dimethoxy-2-(2-phenoxypropanoyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]methoxy}-4-methyl-2H-1-benzopyran-2-one
Chemical Structure Depiction of
7-{[6,7-dimethoxy-2-(2-phenoxypropanoyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]methoxy}-4-methyl-2H-1-benzopyran-2-one
7-{[6,7-dimethoxy-2-(2-phenoxypropanoyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]methoxy}-4-methyl-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | C199-0060 |
| Compound Name: | 7-{[6,7-dimethoxy-2-(2-phenoxypropanoyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]methoxy}-4-methyl-2H-1-benzopyran-2-one |
| Molecular Weight: | 529.59 |
| Molecular Formula: | C31 H31 N O7 |
| Smiles: | CC(C(N1CCc2cc(c(cc2C1COc1ccc2C(C)=CC(=O)Oc2c1)OC)OC)=O)Oc1ccccc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.2627 |
| logD: | 4.2627 |
| logSw: | -4.4422 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.77 |
| InChI Key: | AVYAWRCFYDDOOJ-UHFFFAOYSA-N |