2-(4-chlorophenoxy)-1-{6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}ethan-1-one
Chemical Structure Depiction of
2-(4-chlorophenoxy)-1-{6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}ethan-1-one
2-(4-chlorophenoxy)-1-{6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}ethan-1-one
Compound characteristics
| Compound ID: | K407-0400 |
| Compound Name: | 2-(4-chlorophenoxy)-1-{6,7-dimethoxy-1-[(4-methoxyphenoxy)methyl]-3,4-dihydroisoquinolin-2(1H)-yl}ethan-1-one |
| Molecular Weight: | 497.98 |
| Molecular Formula: | C27 H28 Cl N O6 |
| Smiles: | COc1ccc(cc1)OCC1c2cc(c(cc2CCN1C(COc1ccc(cc1)[Cl])=O)OC)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5458 |
| logD: | 4.5458 |
| logSw: | -4.7346 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 53.089 |
| InChI Key: | YHGROKSVRJNAQY-DEOSSOPVSA-N |