2-{[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-propylbutanamide
Chemical Structure Depiction of
2-{[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-propylbutanamide
2-{[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-propylbutanamide
Compound characteristics
| Compound ID: | V004-2480 |
| Compound Name: | 2-{[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-propylbutanamide |
| Molecular Weight: | 450.62 |
| Molecular Formula: | C28 H38 N2 O3 |
| Smiles: | CCCNC(C(CC)Oc1ccc2CCN(C(c3ccc(C)cc3)c2c1)C(CC(C)C)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.9719 |
| logD: | 5.9719 |
| logSw: | -5.4083 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.804 |
| InChI Key: | HVLGGCNRMBVNAB-UHFFFAOYSA-N |