2-{[2-benzoyl-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-(thiomorpholin-4-yl)propan-1-one
Chemical Structure Depiction of
2-{[2-benzoyl-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-(thiomorpholin-4-yl)propan-1-one
2-{[2-benzoyl-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-(thiomorpholin-4-yl)propan-1-one
Compound characteristics
| Compound ID: | V023-9965 |
| Compound Name: | 2-{[2-benzoyl-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-(thiomorpholin-4-yl)propan-1-one |
| Molecular Weight: | 500.66 |
| Molecular Formula: | C30 H32 N2 O3 S |
| Smiles: | CC(C(N1CCSCC1)=O)Oc1ccc2CCN(C(c3cccc(C)c3)c2c1)C(c1ccccc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.3126 |
| logD: | 5.3126 |
| logSw: | -5.3746 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 39.299 |
| InChI Key: | XSJGGSRUKVVBRW-UHFFFAOYSA-N |