TL;DR: N-Benzyl-N,N-dimethyl-3-(5-methylfuran-2-yl)propan-1-aminium iodide (CAS 25433-43-6) is a chemical compound with molecular formula C17H24INO and molecular weight 385.09027 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzyl-dimethyl-[3-(5-methylfuran-2-yl)propyl]azanium iodide
Also Known As: Benzyldimethyl(3-(5-methyl-2-furyl)propyl)ammonium iodide, AMMONIUM, BENZYLDIMETHYL(3-(5-METHYL-2-FURYL)PROPYL)-, IODIDE, N-Benzyl-N,N-dimethyl-3-(5-methylfuran-2-yl)propan-1-aminium iodide, benzyl-dimethyl-[3-(5-methylfuran-2-yl)propyl]azanium iodide
| Molecular Formula | C17H24INO |
| Molecular Weight | 385.09027 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 13.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 385.09027 Da |
| Heavy Atoms | 20 |
| Complexity | 258.0 |
| SMILES | CC1=CC=C(O1)CCC[N+](C)(C)CC2=CC=CC=C2.[I-] |
| InChIKey | YCCGCUMTGJHQKA-UHFFFAOYSA-M |
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Benzyl-N,N-dimethyl-3-(5-methylfuran-2-yl)propan-1-aminium iodide. With a topological polar surface area (TPSA) of 13.1 Ų, N-Benzyl-N,N-dimethyl-3-(5-methylfuran-2-yl)propan-1-aminium iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Benzyl-N,N-dimethyl-3-(5-methylfuran-2-yl)propan-1-aminium 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 N-Benzyl-N,N-dimethyl-3-(5-methylfuran-2-yl)propan-1-aminium iodide is 25433-43-6.
The molecular formula of N-Benzyl-N,N-dimethyl-3-(5-methylfuran-2-yl)propan-1-aminium iodide is C17H24INO.
The molecular weight of N-Benzyl-N,N-dimethyl-3-(5-methylfuran-2-yl)propan-1-aminium iodide is 385.09027 g/mol.
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