2-{[2-(furan-2-carbonyl)-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-(thiomorpholin-4-yl)propan-1-one
Chemical Structure Depiction of
2-{[2-(furan-2-carbonyl)-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-(thiomorpholin-4-yl)propan-1-one
2-{[2-(furan-2-carbonyl)-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-(thiomorpholin-4-yl)propan-1-one
Compound characteristics
| Compound ID: | V018-2016 |
| Compound Name: | 2-{[2-(furan-2-carbonyl)-1-(3-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}-1-(thiomorpholin-4-yl)propan-1-one |
| Molecular Weight: | 490.62 |
| Molecular Formula: | C28 H30 N2 O4 S |
| Smiles: | CC(C(N1CCSCC1)=O)Oc1ccc2CCN(C(c3cccc(C)c3)c2c1)C(c1ccco1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.629 |
| logD: | 4.629 |
| logSw: | -4.5285 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.877 |
| InChI Key: | LNNMQAWJWLHEAT-UHFFFAOYSA-N |