TL;DR: Tamiflu (CAS 204255-11-8) is a chemical compound with molecular formula C16H31N2O8P and molecular weight 410.1818 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl (3R,4R,5S)-4-acetamido-5-amino-3-pentan-3-yloxycyclohexene-1-carboxylate;phosphoric acid
Also Known As: Oseltamivir phosphate, Tamiflu, Agucort, Oseltamir Phosphate, Aseltamivir phosphate
Top 5 of 12 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C16H31N2O8P |
| Molecular Weight | 410.1818 g/mol |
| XLogP | 0.36 |
| Topological Polar Surface Area (TPSA) | 168.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 410.1818 Da |
| Heavy Atoms | 27 |
| Complexity | 468.0 |
| SMILES | CCC(CC)O[C@@H]1C=C(C[C@@H]([C@H]1NC(=O)C)N)C(=O)OCC.OP(=O)(O)O |
| InChIKey | PGZUMBJQJWIWGJ-ONAKXNSWSA-N |
The XLogP value of 0.36 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tamiflu. The TPSA of 168.0 Ų indicates high polarity, suggesting Tamiflu may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tamiflu has 5 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Tamiflu is 204255-11-8.
The molecular formula of Tamiflu is C16H31N2O8P.
The molecular weight of Tamiflu is 410.1818 g/mol.
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