2-(3-chloro-4-methoxyphenyl)-1-(3-chlorophenyl)-6,7-diethoxy-1,4-dihydroisoquinolin-3(2H)-one
Chemical Structure Depiction of
2-(3-chloro-4-methoxyphenyl)-1-(3-chlorophenyl)-6,7-diethoxy-1,4-dihydroisoquinolin-3(2H)-one
2-(3-chloro-4-methoxyphenyl)-1-(3-chlorophenyl)-6,7-diethoxy-1,4-dihydroisoquinolin-3(2H)-one
Compound characteristics
| Compound ID: | D145-2104 |
| Compound Name: | 2-(3-chloro-4-methoxyphenyl)-1-(3-chlorophenyl)-6,7-diethoxy-1,4-dihydroisoquinolin-3(2H)-one |
| Molecular Weight: | 486.39 |
| Molecular Formula: | C26 H25 Cl2 N O4 |
| Smiles: | CCOc1cc2CC(N(C(c3cccc(c3)[Cl])c2cc1OCC)c1ccc(c(c1)[Cl])OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2661 |
| logD: | 5.2661 |
| logSw: | -5.9752 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.368 |
| InChI Key: | VSTTUQVEBWHNHR-SANMLTNESA-N |