2-{[2-(cyclopentanecarbonyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-(2-methylpropyl)acetamide
Chemical Structure Depiction of
2-{[2-(cyclopentanecarbonyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-(2-methylpropyl)acetamide
2-{[2-(cyclopentanecarbonyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-(2-methylpropyl)acetamide
Compound characteristics
| Compound ID: | V003-1413 |
| Compound Name: | 2-{[2-(cyclopentanecarbonyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-(2-methylpropyl)acetamide |
| Molecular Weight: | 448.61 |
| Molecular Formula: | C28 H36 N2 O3 |
| Smiles: | CC(C)CNC(COc1ccc2CCN(C(c3ccc(C)cc3)c2c1)C(C1CCCC1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4688 |
| logD: | 5.4688 |
| logSw: | -5.2596 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.39 |
| InChI Key: | HGGOUWFQIJUJDZ-MHZLTWQESA-N |