{6,7-dimethoxy-1-[(4-nitrophenoxy)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}(3,5-dimethoxyphenyl)methanone
Chemical Structure Depiction of
{6,7-dimethoxy-1-[(4-nitrophenoxy)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}(3,5-dimethoxyphenyl)methanone
{6,7-dimethoxy-1-[(4-nitrophenoxy)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}(3,5-dimethoxyphenyl)methanone
Compound characteristics
| Compound ID: | K407-0241 |
| Compound Name: | {6,7-dimethoxy-1-[(4-nitrophenoxy)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}(3,5-dimethoxyphenyl)methanone |
| Molecular Weight: | 508.53 |
| Molecular Formula: | C27 H28 N2 O8 |
| Smiles: | COc1cc(cc(c1)OC)C(N1CCc2cc(c(cc2C1COc1ccc(cc1)[N+]([O-])=O)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2984 |
| logD: | 4.2984 |
| logSw: | -4.306 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.043 |
| InChI Key: | DFAGKTZBHRCVCH-DEOSSOPVSA-N |