N-(3-methylbutyl)-2-[(1-phenyl-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl)oxy]propanamide
Chemical Structure Depiction of
N-(3-methylbutyl)-2-[(1-phenyl-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl)oxy]propanamide
N-(3-methylbutyl)-2-[(1-phenyl-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl)oxy]propanamide
Compound characteristics
| Compound ID: | V029-5815 |
| Compound Name: | N-(3-methylbutyl)-2-[(1-phenyl-2-propanoyl-1,2,3,4-tetrahydroisoquinolin-7-yl)oxy]propanamide |
| Molecular Weight: | 422.57 |
| Molecular Formula: | C26 H34 N2 O3 |
| Smiles: | CCC(N1CCc2ccc(cc2C1c1ccccc1)OC(C)C(NCCC(C)C)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.9928 |
| logD: | 4.9928 |
| logSw: | -4.4795 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.921 |
| InChI Key: | CTHFXZQUFDTYRH-UHFFFAOYSA-N |