N-{2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}-2-methoxy-4-(methylsulfanyl)benzamide
Chemical Structure Depiction of
N-{2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}-2-methoxy-4-(methylsulfanyl)benzamide
N-{2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}-2-methoxy-4-(methylsulfanyl)benzamide
Compound characteristics
| Compound ID: | 8017-0673 |
| Compound Name: | N-{2-[(6,7-dimethoxyisoquinolin-1-yl)methyl]-4,5-dimethoxyphenyl}-2-methoxy-4-(methylsulfanyl)benzamide |
| Molecular Weight: | 534.63 |
| Molecular Formula: | C29 H30 N2 O6 S |
| Smiles: | COc1cc(ccc1C(Nc1cc(c(cc1Cc1c2cc(c(cc2ccn1)OC)OC)OC)OC)=O)SC |
| Stereo: | ACHIRAL |
| logP: | 4.6837 |
| logD: | 4.6663 |
| logSw: | -4.5254 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.554 |
| InChI Key: | HIFSNCAWBUPRHZ-UHFFFAOYSA-N |