1-(4-chlorophenyl)-6,7-diethoxy-2-(4-methoxyphenyl)-1,4-dihydroisoquinolin-3(2H)-one
Chemical Structure Depiction of
1-(4-chlorophenyl)-6,7-diethoxy-2-(4-methoxyphenyl)-1,4-dihydroisoquinolin-3(2H)-one
1-(4-chlorophenyl)-6,7-diethoxy-2-(4-methoxyphenyl)-1,4-dihydroisoquinolin-3(2H)-one
Compound characteristics
Compound ID: | D081-0018 |
Compound Name: | 1-(4-chlorophenyl)-6,7-diethoxy-2-(4-methoxyphenyl)-1,4-dihydroisoquinolin-3(2H)-one |
Molecular Weight: | 451.95 |
Molecular Formula: | C26 H26 Cl N O4 |
Smiles: | CCOc1cc2CC(N(C(c3ccc(cc3)[Cl])c2cc1OCC)c1ccc(cc1)OC)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.8498 |
logD: | 4.8498 |
logSw: | -5.1438 |
Hydrogen bond acceptors count: | 5 |
Polar surface area: | 37.282 |
InChI Key: | ICXBLIHPEQODQG-SANMLTNESA-N |