2-{[2-(2,2-dimethylpropanoyl)-1-(4-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-(morpholin-4-yl)butan-1-one
Chemical Structure Depiction of
2-{[2-(2,2-dimethylpropanoyl)-1-(4-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-(morpholin-4-yl)butan-1-one
2-{[2-(2,2-dimethylpropanoyl)-1-(4-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-(morpholin-4-yl)butan-1-one
Compound characteristics
| Compound ID: | V016-0182 |
| Compound Name: | 2-{[2-(2,2-dimethylpropanoyl)-1-(4-fluorophenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-(morpholin-4-yl)butan-1-one |
| Molecular Weight: | 482.6 |
| Molecular Formula: | C28 H35 F N2 O4 |
| Smiles: | CCC(C(N1CCOCC1)=O)Oc1ccc2CCN(C(c3ccc(cc3)F)c2c1)C(C(C)(C)C)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7638 |
| logD: | 4.7638 |
| logSw: | -4.5663 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.362 |
| InChI Key: | GSCVVYKPKMJDEU-UHFFFAOYSA-N |