2-{[2-acetyl-1-(4-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-ethyl-N-methylbutanamide
Chemical Structure Depiction of
2-{[2-acetyl-1-(4-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-ethyl-N-methylbutanamide
2-{[2-acetyl-1-(4-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-ethyl-N-methylbutanamide
Compound characteristics
| Compound ID: | V023-7475 |
| Compound Name: | 2-{[2-acetyl-1-(4-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-ethyl-N-methylbutanamide |
| Molecular Weight: | 412.5 |
| Molecular Formula: | C24 H29 F N2 O3 |
| Smiles: | CCC(C(N(C)CC)=O)Oc1ccc2CCN(C(c3ccc(cc3)F)c2c1)C(C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8818 |
| logD: | 3.8818 |
| logSw: | -3.8512 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.42 |
| InChI Key: | KPRSWNRDCUVUDK-UHFFFAOYSA-N |