TL;DR: 4-Carbamimidamido-N,N,N-trimethylbutan-1-aminium iodide--hydrogen iodide (1/1/1) (CAS 92442-91-6) is a chemical compound with molecular formula C8H22I2N4 and molecular weight 427.99338 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(diaminomethylideneazaniumyl)butyl-trimethylazanium diiodide
Also Known As: (4-Guanidinobutyl)trimethylammonium iodide hydriodide, AMMONIUM, (4-GUANIDINOBUTYL)TRIMETHYL-, IODIDE, HYDRIODIDE, 4-(diaminomethylideneazaniumyl)butyl-trimethylazanium diiodide, 4-Carbamimidamido-N,N,N-trimethylbutan-1-aminium iodide--hydrogen iodide (1/1/1)
| Molecular Formula | C8H22I2N4 |
| Molecular Weight | 427.99338 g/mol |
| XLogP | -8.17 |
| Topological Polar Surface Area (TPSA) | 66.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 427.99338 Da |
| Heavy Atoms | 14 |
| Complexity | 142.0 |
| SMILES | C[N+](C)(C)CCCC[NH+]=C(N)N.[I-].[I-] |
| InChIKey | WSVDMKBXTOVTHK-UHFFFAOYSA-M |
The XLogP value of -8.17 indicates that 4-Carbamimidamido-N,N,N-trimethylbutan-1-aminium iodide--hydrogen iodide (1/1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Carbamimidamido-N,N,N-trimethylbutan-1-aminium iodide--hydrogen iodide (1/1/1). Following Lipinski's Rule of Five, 4-Carbamimidamido-N,N,N-trimethylbutan-1-aminium iodide--hydrogen iodide (1/1/1) has 3 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 4-Carbamimidamido-N,N,N-trimethylbutan-1-aminium iodide--hydrogen iodide (1/1/1) is 92442-91-6.
The molecular formula of 4-Carbamimidamido-N,N,N-trimethylbutan-1-aminium iodide--hydrogen iodide (1/1/1) is C8H22I2N4.
The molecular weight of 4-Carbamimidamido-N,N,N-trimethylbutan-1-aminium iodide--hydrogen iodide (1/1/1) is 427.99338 g/mol.
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