TL;DR: Ammonium, (5-benzoyl-5-phenylpentyl)triethyl-, iodide (CAS 38940-51-1) is a chemical compound with molecular formula C24H34INO and molecular weight 479.16852 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
triethyl-(6-oxo-5,6-diphenylhexyl)azanium iodide
Also Known As: (5-Benzoyl-5-phenylpentyl)triethylammonium iodide, triethyl-(6-oxo-5,6-diphenylhexyl)azanium iodide, AMMONIUM, (5-BENZOYL-5-PHENYLPENTYL)TRIETHYL-, IODIDE, Benzoin, deoxy(alpha-(4-triethylammonio)butyl)-, iodide, N,N,N-Triethyl-6-oxo-5,6-diphenylhexan-1-aminium iodide
| Molecular Formula | C24H34INO |
| Molecular Weight | 479.16852 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 11 |
| Exact Mass | 479.16852 Da |
| Heavy Atoms | 27 |
| Complexity | 381.0 |
| SMILES | CC[N+](CC)(CC)CCCCC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2.[I-] |
| InChIKey | FXDHBUYBUCTBQD-UHFFFAOYSA-M |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium, (5-benzoyl-5-phenylpentyl)triethyl-, iodide. With a topological polar surface area (TPSA) of 17.1 Ų, Ammonium, (5-benzoyl-5-phenylpentyl)triethyl-, iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, (5-benzoyl-5-phenylpentyl)triethyl-, iodide has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Ammonium, (5-benzoyl-5-phenylpentyl)triethyl-, iodide is 38940-51-1.
The molecular formula of Ammonium, (5-benzoyl-5-phenylpentyl)triethyl-, iodide is C24H34INO.
The molecular weight of Ammonium, (5-benzoyl-5-phenylpentyl)triethyl-, iodide is 479.16852 g/mol.
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