N-benzyl-2-{[1-(3-fluorophenyl)-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}propanamide
Chemical Structure Depiction of
N-benzyl-2-{[1-(3-fluorophenyl)-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}propanamide
N-benzyl-2-{[1-(3-fluorophenyl)-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}propanamide
Compound characteristics
| Compound ID: | V025-0499 |
| Compound Name: | N-benzyl-2-{[1-(3-fluorophenyl)-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}propanamide |
| Molecular Weight: | 460.55 |
| Molecular Formula: | C28 H29 F N2 O3 |
| Smiles: | CCC(N1CCc2ccc(cc2C1c1cccc(c1)F)OC(C)C(NCc1ccccc1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.808 |
| logD: | 4.808 |
| logSw: | -4.4757 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.808 |
| InChI Key: | UTHUKMBQYZABAS-UHFFFAOYSA-N |