2-methyl-1-[1-phenyl-7-{[5-(thiomorpholine-4-carbonyl)furan-2-yl]methoxy}-3,4-dihydroisoquinolin-2(1H)-yl]propan-1-one
Chemical Structure Depiction of
2-methyl-1-[1-phenyl-7-{[5-(thiomorpholine-4-carbonyl)furan-2-yl]methoxy}-3,4-dihydroisoquinolin-2(1H)-yl]propan-1-one
2-methyl-1-[1-phenyl-7-{[5-(thiomorpholine-4-carbonyl)furan-2-yl]methoxy}-3,4-dihydroisoquinolin-2(1H)-yl]propan-1-one
Compound characteristics
| Compound ID: | V024-3753 |
| Compound Name: | 2-methyl-1-[1-phenyl-7-{[5-(thiomorpholine-4-carbonyl)furan-2-yl]methoxy}-3,4-dihydroisoquinolin-2(1H)-yl]propan-1-one |
| Molecular Weight: | 504.65 |
| Molecular Formula: | C29 H32 N2 O4 S |
| Smiles: | CC(C)C(N1CCc2ccc(cc2C1c1ccccc1)OCc1ccc(C(N2CCSCC2)=O)o1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1968 |
| logD: | 5.1968 |
| logSw: | -5.082 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.85 |
| InChI Key: | AISIKIDJIOMGEC-MHZLTWQESA-N |