TL;DR: Ammonium, sulfinyldiethylenebis(ethyldimethyl-, dibromide (CAS 63951-31-5) is a chemical compound with molecular formula C12H30Br2N2OS and molecular weight 408.04456 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl-[2-[2-[ethyl(dimethyl)azaniumyl]ethylsulfinyl]ethyl]-dimethylazanium dibromide
Also Known As: AMMONIUM, SULFINYLDIETHYLENEBIS(ETHYLDIMETHYL-, DIBROMIDE, Ethanaminium, 2,2'-sulfinylbis[N-ethyl-N,N-dimethyl-, dibromide, ethyl-[2-[2-[ethyl(dimethyl)azaniumyl]ethylsulfinyl]ethyl]-dimethylazanium dibromide, N,N'-[Sulfinyldi(ethane-2,1-diyl)]bis(N,N-dimethylethan-1-aminium) dibromide
| Molecular Formula | C12H30Br2N2OS |
| Molecular Weight | 408.04456 g/mol |
| XLogP | -5.06 |
| Topological Polar Surface Area (TPSA) | 36.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 410.0425 Da |
| Heavy Atoms | 18 |
| Complexity | 205.0 |
| SMILES | CC[N+](C)(C)CCS(=O)CC[N+](C)(C)CC.[Br-].[Br-] |
| InChIKey | IFRTXENWUYJADC-UHFFFAOYSA-L |
The XLogP value of -5.06 indicates that Ammonium, sulfinyldiethylenebis(ethyldimethyl-, dibromide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 36.3 Ų, Ammonium, sulfinyldiethylenebis(ethyldimethyl-, dibromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, sulfinyldiethylenebis(ethyldimethyl-, dibromide has 0 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 Ammonium, sulfinyldiethylenebis(ethyldimethyl-, dibromide is 63951-31-5.
The molecular formula of Ammonium, sulfinyldiethylenebis(ethyldimethyl-, dibromide is C12H30Br2N2OS.
The molecular weight of Ammonium, sulfinyldiethylenebis(ethyldimethyl-, dibromide is 408.04456 g/mol.
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