2-{[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-(2-methylpropyl)acetamide
Chemical Structure Depiction of
2-{[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-(2-methylpropyl)acetamide
2-{[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-(2-methylpropyl)acetamide
Compound characteristics
| Compound ID: | V030-1229 |
| Compound Name: | 2-{[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-(2-methylpropyl)acetamide |
| Molecular Weight: | 436.59 |
| Molecular Formula: | C27 H36 N2 O3 |
| Smiles: | CC(C)CC(N1CCc2ccc(cc2C1c1ccc(C)cc1)OCC(NCC(C)C)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.2984 |
| logD: | 5.2984 |
| logSw: | -5.2983 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.576 |
| InChI Key: | BPVUJJFVHSAGAT-MHZLTWQESA-N |