2-{[2-(2,2-dimethylpropanoyl)-1-(3-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-propylpropanamide
Chemical Structure Depiction of
2-{[2-(2,2-dimethylpropanoyl)-1-(3-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-propylpropanamide
2-{[2-(2,2-dimethylpropanoyl)-1-(3-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-propylpropanamide
Compound characteristics
| Compound ID: | V030-1204 |
| Compound Name: | 2-{[2-(2,2-dimethylpropanoyl)-1-(3-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-propylpropanamide |
| Molecular Weight: | 440.56 |
| Molecular Formula: | C26 H33 F N2 O3 |
| Smiles: | CCCNC(C(C)Oc1ccc2CCN(C(c3cccc(c3)F)c2c1)C(C(C)(C)C)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.0459 |
| logD: | 5.0459 |
| logSw: | -4.6226 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.448 |
| InChI Key: | UENROFWBLNVCDF-UHFFFAOYSA-N |