2-{[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-(2-methylpropyl)propanamide
Chemical Structure Depiction of
2-{[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-(2-methylpropyl)propanamide
2-{[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-(2-methylpropyl)propanamide
Compound characteristics
| Compound ID: | V004-2467 |
| Compound Name: | 2-{[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-(2-methylpropyl)propanamide |
| Molecular Weight: | 450.62 |
| Molecular Formula: | C28 H38 N2 O3 |
| Smiles: | CC(C)CC(N1CCc2ccc(cc2C1c1ccc(C)cc1)OC(C)C(NCC(C)C)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.8458 |
| logD: | 5.8458 |
| logSw: | -5.4388 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.079 |
| InChI Key: | IOEDEHFZQUYCHT-UHFFFAOYSA-N |