TL;DR: 1,6-Dideoxy-1,6-diiodohexitol (CAS 15430-91-8) is a chemical compound with molecular formula C6H12I2O4 and molecular weight 401.8825 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,6-diiodohexane-2,3,4,5-tetrol
Also Known As: D-Glucamine, 1,6-didesoxy-D-mannit, 1,6-diiodo-D-mannitol, 1,6-diiodo-D-mannitol-, 1,6-diiodohexane-2,3,4,5-tetrol
Top 5 of 19 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C6H12I2O4 |
| Molecular Weight | 401.8825 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 80.9 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 401.8825 Da |
| Heavy Atoms | 12 |
| Complexity | 110.0 |
| SMILES | C(C(C(C(C(CI)O)O)O)O)I |
| InChIKey | VSJYBSKARROHOH-UHFFFAOYSA-N |
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,6-Dideoxy-1,6-diiodohexitol. The TPSA of 80.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,6-Dideoxy-1,6-diiodohexitol. Following Lipinski's Rule of Five, 1,6-Dideoxy-1,6-diiodohexitol has 4 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1,6-Dideoxy-1,6-diiodohexitol is 15430-91-8.
The molecular formula of 1,6-Dideoxy-1,6-diiodohexitol is C6H12I2O4.
The molecular weight of 1,6-Dideoxy-1,6-diiodohexitol is 401.8825 g/mol.
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