{6,7-dimethoxy-1-[(2-methoxyphenoxy)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}(2-methyl-3-nitrophenyl)methanone
Chemical Structure Depiction of
{6,7-dimethoxy-1-[(2-methoxyphenoxy)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}(2-methyl-3-nitrophenyl)methanone
{6,7-dimethoxy-1-[(2-methoxyphenoxy)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}(2-methyl-3-nitrophenyl)methanone
Compound characteristics
| Compound ID: | K407-0225 |
| Compound Name: | {6,7-dimethoxy-1-[(2-methoxyphenoxy)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}(2-methyl-3-nitrophenyl)methanone |
| Molecular Weight: | 492.53 |
| Molecular Formula: | C27 H28 N2 O7 |
| Smiles: | Cc1c(cccc1[N+]([O-])=O)C(N1CCc2cc(c(cc2C1COc1ccccc1OC)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3567 |
| logD: | 4.3567 |
| logSw: | -4.4904 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.371 |
| InChI Key: | CIAJQKFRXSUZJZ-QFIPXVFZSA-N |