N-(4-fluorophenyl)-2-{[1-(3-fluorophenyl)-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}butanamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-2-{[1-(3-fluorophenyl)-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}butanamide
N-(4-fluorophenyl)-2-{[1-(3-fluorophenyl)-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}butanamide
Compound characteristics
| Compound ID: | V016-3290 |
| Compound Name: | N-(4-fluorophenyl)-2-{[1-(3-fluorophenyl)-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}butanamide |
| Molecular Weight: | 478.54 |
| Molecular Formula: | C28 H28 F2 N2 O3 |
| Smiles: | CCC(C(Nc1ccc(cc1)F)=O)Oc1ccc2CCN(C(c3cccc(c3)F)c2c1)C(CC)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.8906 |
| logD: | 5.8902 |
| logSw: | -5.5072 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.369 |
| InChI Key: | CHOAYQHTDSVXQQ-UHFFFAOYSA-N |