TL;DR: [Methylsulfanyl(thiophen-2-ylsulfanyl)methylidene]cyanamide (CAS 100477-76-7) is a chemical compound with molecular formula C7H6N2S3 and molecular weight 213.96931 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[methylsulfanyl(thiophen-2-ylsulfanyl)methylidene]cyanamide
Also Known As: Methyl (thiophen-2-yl) cyanocarbonimidodithioate, Methyl thiophen-2-yl cyanocarbonodithioimidate, [methylsulfanyl(thiophen-2-ylsulfanyl)methylidene]cyanamide, methyl 2-thienyl cyanodithioimidocarbonate, Methyl(thiophen-2-yl)cyanocarbonimidodithioate
| Molecular Formula | C7H6N2S3 |
| Molecular Weight | 213.96931 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 115.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 213.96931 Da |
| Heavy Atoms | 12 |
| Complexity | 218.0 |
| SMILES | CSC(=NC#N)SC1=CC=CS1 |
| InChIKey | COAKJSUMLBSEBJ-UHFFFAOYSA-N |
The XLogP value of 3.5 indicates that [Methylsulfanyl(thiophen-2-ylsulfanyl)methylidene]cyanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [Methylsulfanyl(thiophen-2-ylsulfanyl)methylidene]cyanamide. Following Lipinski's Rule of Five, [Methylsulfanyl(thiophen-2-ylsulfanyl)methylidene]cyanamide has 0 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 [Methylsulfanyl(thiophen-2-ylsulfanyl)methylidene]cyanamide is 100477-76-7.
The molecular formula of [Methylsulfanyl(thiophen-2-ylsulfanyl)methylidene]cyanamide is C7H6N2S3.
The molecular weight of [Methylsulfanyl(thiophen-2-ylsulfanyl)methylidene]cyanamide is 213.96931 g/mol.
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