N-ethyl-2-{[1-(4-fluorophenyl)-2-(furan-2-carbonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}butanamide
Chemical Structure Depiction of
N-ethyl-2-{[1-(4-fluorophenyl)-2-(furan-2-carbonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}butanamide
N-ethyl-2-{[1-(4-fluorophenyl)-2-(furan-2-carbonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}butanamide
Compound characteristics
| Compound ID: | V005-0864 |
| Compound Name: | N-ethyl-2-{[1-(4-fluorophenyl)-2-(furan-2-carbonyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}butanamide |
| Molecular Weight: | 450.51 |
| Molecular Formula: | C26 H27 F N2 O4 |
| Smiles: | CCC(C(NCC)=O)Oc1ccc2CCN(C(c3ccc(cc3)F)c2c1)C(c1ccco1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.495 |
| logD: | 4.495 |
| logSw: | -4.2201 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.423 |
| InChI Key: | ZVMKQIVVUBVAOH-UHFFFAOYSA-N |