TL;DR: Sch 50673 (CAS 159344-43-1) is a chemical compound with molecular formula C21H14O8 and molecular weight 394.06888 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1'S,2'R,3'S,5'R,7'R)-2'-hydroxy-2'-methoxyspiro[2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene-3,6'-4,12-dioxatetracyclo[5.4.1.01,7.03,5]dodec-9-ene]-8',11'-dione
Also Known As: Sch 50673, (1'S,2'R,3'S,5'R,7'R)-2'-Hydroxy-2'-methoxyspiro[2,4-dioxatricyclo[7.3.1.05,13]trideca-1(12),5,7,9(13),10-pentaene-3,6'-4,12-dioxatetracyclo[5.4.1.01,7.03,5]dodec-9-ene]-8',11'-dione, (1'S,2'R,3'S,5'R,7'R)-2'-hydroxy-2'-methoxyspiro(2,4-dioxatricyclo(7.3.1.05,13)trideca-1(12),5,7,9(13),10-pentaene-3,6'-4,12-dioxatetracyclo(5.4.1.01,7.03,5)dodec-9-ene)-8',11'-dione
| Molecular Formula | C21H14O8 |
| Molecular Weight | 394.06888 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 107.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 1 |
| Exact Mass | 394.06888 Da |
| Heavy Atoms | 29 |
| Complexity | 849.0 |
| SMILES | CO[C@@]1([C@@H]2[C@@H](O2)C3([C@]45[C@]1(O4)C(=O)C=CC5=O)OC6=CC=CC7=C6C(=CC=C7)O3)O |
| InChIKey | MYXNJIZFJSNFMA-MFKWGIFDSA-N |
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sch 50673. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Sch 50673. Following Lipinski's Rule of Five, Sch 50673 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Sch 50673 is 159344-43-1.
The molecular formula of Sch 50673 is C21H14O8.
The molecular weight of Sch 50673 is 394.06888 g/mol.
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