TL;DR: (Dimethylamino)((dimethylcarbamoyl)disulfanyl)thioxomethane (CAS 124534-14-1) is a chemical compound with molecular formula C6H12N2OS3 and molecular weight 224.01117 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
S-(dimethylcarbamothioylsulfanyl) N,N-dimethylcarbamothioate
Also Known As: KST-1A0936, (dimethylamino)[(dimethylcarbamoyl)disulfanyl]thioxomethane, J1.143.913F, S-(dimethylcarbamothioylsulfanyl) N,N-dimethylcarbamothioate, Dimethylthiocarbamoyl(dimethylcarbamoyl) persulfide
| Molecular Formula | C6H12N2OS3 |
| Molecular Weight | 224.01117 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 106.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 224.01117 Da |
| Heavy Atoms | 12 |
| Complexity | 182.0 |
| SMILES | CN(C)C(=O)SSC(=S)N(C)C |
| InChIKey | HXUATFGAHUOFRN-UHFFFAOYSA-N |
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Dimethylamino)((dimethylcarbamoyl)disulfanyl)thioxomethane. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (Dimethylamino)((dimethylcarbamoyl)disulfanyl)thioxomethane. Following Lipinski's Rule of Five, (Dimethylamino)((dimethylcarbamoyl)disulfanyl)thioxomethane 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 (Dimethylamino)((dimethylcarbamoyl)disulfanyl)thioxomethane is 124534-14-1.
The molecular formula of (Dimethylamino)((dimethylcarbamoyl)disulfanyl)thioxomethane is C6H12N2OS3.
The molecular weight of (Dimethylamino)((dimethylcarbamoyl)disulfanyl)thioxomethane is 224.01117 g/mol.
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