2-{[2-(cyclopentanecarbonyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-(propan-2-yl)butanamide
Chemical Structure Depiction of
2-{[2-(cyclopentanecarbonyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-(propan-2-yl)butanamide
2-{[2-(cyclopentanecarbonyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-(propan-2-yl)butanamide
Compound characteristics
| Compound ID: | V004-7011 |
| Compound Name: | 2-{[2-(cyclopentanecarbonyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-N-(propan-2-yl)butanamide |
| Molecular Weight: | 462.63 |
| Molecular Formula: | C29 H38 N2 O3 |
| Smiles: | CCC(C(NC(C)C)=O)Oc1ccc2CCN(C(c3ccc(C)cc3)c2c1)C(C1CCCC1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.1872 |
| logD: | 6.1872 |
| logSw: | -5.2891 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.751 |
| InChI Key: | SQOXXIPXHPBWIR-UHFFFAOYSA-N |