N-(2-methoxyethyl)-2-{[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}propanamide
Chemical Structure Depiction of
N-(2-methoxyethyl)-2-{[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}propanamide
N-(2-methoxyethyl)-2-{[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}propanamide
Compound characteristics
| Compound ID: | V004-2479 |
| Compound Name: | N-(2-methoxyethyl)-2-{[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}propanamide |
| Molecular Weight: | 452.59 |
| Molecular Formula: | C27 H36 N2 O4 |
| Smiles: | CC(C)CC(N1CCc2ccc(cc2C1c1ccc(C)cc1)OC(C)C(NCCOC)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.6682 |
| logD: | 4.6682 |
| logSw: | -4.238 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.263 |
| InChI Key: | XZPBLCOIRAZUAN-UHFFFAOYSA-N |