2-{[2-(3-methylbutanoyl)-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-(morpholin-4-yl)butan-1-one
Chemical Structure Depiction of
2-{[2-(3-methylbutanoyl)-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-(morpholin-4-yl)butan-1-one
2-{[2-(3-methylbutanoyl)-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-(morpholin-4-yl)butan-1-one
Compound characteristics
| Compound ID: | V021-5054 |
| Compound Name: | 2-{[2-(3-methylbutanoyl)-1-phenyl-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-(morpholin-4-yl)butan-1-one |
| Molecular Weight: | 464.61 |
| Molecular Formula: | C28 H36 N2 O4 |
| Smiles: | CCC(C(N1CCOCC1)=O)Oc1ccc2CCN(C(c3ccccc3)c2c1)C(CC(C)C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7569 |
| logD: | 4.7569 |
| logSw: | -4.5172 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.834 |
| InChI Key: | XIBLYSFFLUIQAI-UHFFFAOYSA-N |