N-ethyl-2-{[2-(3-methylbutanoyl)-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}butanamide
Chemical Structure Depiction of
N-ethyl-2-{[2-(3-methylbutanoyl)-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}butanamide
N-ethyl-2-{[2-(3-methylbutanoyl)-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}butanamide
Compound characteristics
| Compound ID: | V028-5008 |
| Compound Name: | N-ethyl-2-{[2-(3-methylbutanoyl)-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}butanamide |
| Molecular Weight: | 422.57 |
| Molecular Formula: | C26 H34 N2 O3 |
| Smiles: | CCC(C(NCC)=O)Oc1ccc2CCN(C(c3ccccc3)c2c1)C(CC(C)C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.0867 |
| logD: | 5.0867 |
| logSw: | -4.8704 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.588 |
| InChI Key: | GDUMJAAPNOZYKG-UHFFFAOYSA-N |