2-{[1-(4-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-(2-methoxyethyl)butanamide
Chemical Structure Depiction of
2-{[1-(4-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-(2-methoxyethyl)butanamide
2-{[1-(4-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-(2-methoxyethyl)butanamide
Compound characteristics
| Compound ID: | V024-4096 |
| Compound Name: | 2-{[1-(4-fluorophenyl)-2-(2-methylpropanoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-(2-methoxyethyl)butanamide |
| Molecular Weight: | 456.56 |
| Molecular Formula: | C26 H33 F N2 O4 |
| Smiles: | CCC(C(NCCOC)=O)Oc1ccc2CCN(C(c3ccc(cc3)F)c2c1)C(C(C)C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.443 |
| logD: | 4.443 |
| logSw: | -4.235 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.674 |
| InChI Key: | NXYQGCKPTHHQIH-UHFFFAOYSA-N |