2-(3-chlorophenyl)-1-(4-fluorophenyl)-6,7-dimethoxy-1,4-dihydroisoquinolin-3(2H)-one
Chemical Structure Depiction of
2-(3-chlorophenyl)-1-(4-fluorophenyl)-6,7-dimethoxy-1,4-dihydroisoquinolin-3(2H)-one
2-(3-chlorophenyl)-1-(4-fluorophenyl)-6,7-dimethoxy-1,4-dihydroisoquinolin-3(2H)-one
Compound characteristics
| Compound ID: | D145-0161 |
| Compound Name: | 2-(3-chlorophenyl)-1-(4-fluorophenyl)-6,7-dimethoxy-1,4-dihydroisoquinolin-3(2H)-one |
| Molecular Weight: | 411.86 |
| Molecular Formula: | C23 H19 Cl F N O3 |
| Smiles: | COc1cc2CC(N(C(c3ccc(cc3)F)c2cc1OC)c1cccc(c1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6652 |
| logD: | 4.6652 |
| logSw: | -5.119 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.5782 |
| InChI Key: | XSYQZAHOGZTUHO-QHCPKHFHSA-N |