1-[1-(2-chlorophenyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl]-2-{5-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-oxazol-4-yl}ethan-1-one
Chemical Structure Depiction of
1-[1-(2-chlorophenyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl]-2-{5-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-oxazol-4-yl}ethan-1-one
1-[1-(2-chlorophenyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl]-2-{5-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-oxazol-4-yl}ethan-1-one
Compound characteristics
| Compound ID: | V009-5713 |
| Compound Name: | 1-[1-(2-chlorophenyl)-6,7-dimethoxy-3,4-dihydroisoquinolin-2(1H)-yl]-2-{5-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-oxazol-4-yl}ethan-1-one |
| Molecular Weight: | 571 |
| Molecular Formula: | C30 H26 Cl F3 N2 O4 |
| Smiles: | Cc1c(CC(N2CCc3cc(c(cc3C2c2ccccc2[Cl])OC)OC)=O)nc(c2ccc(cc2)C(F)(F)F)o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.297 |
| logD: | 6.297 |
| logSw: | -6.1455 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 48.717 |
| InChI Key: | WOIOJHGBJPAEPG-NDEPHWFRSA-N |