TL;DR: S-(2-(Dimethylamino)-2-iminoethyl) hydrogen thiosulfate (CAS 10319-72-9) is a chemical compound with molecular formula C4H10N2O3S2 and molecular weight 198.01329 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(dimethylamino)-1-imino-2-sulfosulfanylethane
Also Known As: 1-(dimethylamino)-1-imino-2-sulfosulfanylethane, 2-
| Molecular Formula | C4H10N2O3S2 |
| Molecular Weight | 198.01329 g/mol |
| XLogP | -0.8 |
| Topological Polar Surface Area (TPSA) | 115.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 198.01329 Da |
| Heavy Atoms | 11 |
| Complexity | 228.0 |
| SMILES | CN(C)C(=N)CSS(=O)(=O)O |
| InChIKey | VAJZTLPJFFJLIZ-UHFFFAOYSA-N |
The XLogP value of -0.8 indicates that S-(2-(Dimethylamino)-2-iminoethyl) hydrogen thiosulfate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for S-(2-(Dimethylamino)-2-iminoethyl) hydrogen thiosulfate. Following Lipinski's Rule of Five, S-(2-(Dimethylamino)-2-iminoethyl) hydrogen thiosulfate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of S-(2-(Dimethylamino)-2-iminoethyl) hydrogen thiosulfate is 10319-72-9.
The molecular formula of S-(2-(Dimethylamino)-2-iminoethyl) hydrogen thiosulfate is C4H10N2O3S2.
The molecular weight of S-(2-(Dimethylamino)-2-iminoethyl) hydrogen thiosulfate is 198.01329 g/mol.
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