2-(4-chlorophenyl)-1-(3,4-dimethoxyphenyl)-6,7-diethoxy-1,4-dihydroisoquinolin-3(2H)-one
Chemical Structure Depiction of
2-(4-chlorophenyl)-1-(3,4-dimethoxyphenyl)-6,7-diethoxy-1,4-dihydroisoquinolin-3(2H)-one
2-(4-chlorophenyl)-1-(3,4-dimethoxyphenyl)-6,7-diethoxy-1,4-dihydroisoquinolin-3(2H)-one
Compound characteristics
| Compound ID: | D081-0011 |
| Compound Name: | 2-(4-chlorophenyl)-1-(3,4-dimethoxyphenyl)-6,7-diethoxy-1,4-dihydroisoquinolin-3(2H)-one |
| Molecular Weight: | 481.98 |
| Molecular Formula: | C27 H28 Cl N O5 |
| Smiles: | CCOc1cc2CC(N(C(c3ccc(c(c3)OC)OC)c2cc1OCC)c1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.53 |
| logD: | 4.53 |
| logSw: | -4.9355 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.999 |
| InChI Key: | SDHHEDHHIGTIHD-MHZLTWQESA-N |