1-[1-(4-chlorophenyl)-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-(4-chlorophenyl)-3,4-dihydroisoquinolin-2(1H)-yl]-2-{5-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-oxazol-4-yl}ethan-1-one
1-[1-(4-chlorophenyl)-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: | V001-6587 |
| Compound Name: | 1-[1-(4-chlorophenyl)-3,4-dihydroisoquinolin-2(1H)-yl]-2-{5-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-oxazol-4-yl}ethan-1-one |
| Molecular Weight: | 510.94 |
| Molecular Formula: | C28 H22 Cl F3 N2 O2 |
| Smiles: | Cc1c(CC(N2CCc3ccccc3C2c2ccc(cc2)[Cl])=O)nc(c2ccc(cc2)C(F)(F)F)o1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 7.1646 |
| logD: | 7.1646 |
| logSw: | -6.4582 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 33.456 |
| InChI Key: | PLRULAQHFSEXGY-SANMLTNESA-N |