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[Methylsulfanyl(phenylsulfanyl)methylidene]cyanamide
TL;DR: [Methylsulfanyl(phenylsulfanyl)methylidene]cyanamide (CAS 152381-91-4) is a chemical compound with molecular formula C9H8N2S2 and molecular weight 208.0129 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[methylsulfanyl(phenylsulfanyl)methylidene]cyanamide
Also Known As: Methyl phenyl cyanocarbonimidodithioate, [methylsulfanyl(phenylsulfanyl)methylidene]cyanamide, Methyl phenyl cyanocarbonodithioimidate, [(methylthio)-(phenylthio)methylidene]cyanamide, Carbonimidodithioicacid, cyano-, methyl phenyl ester (9CI)
Technical Specifications
| Molecular Formula | C9H8N2S2 |
| Molecular Weight | 208.0129 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 86.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 208.0129 Da |
| Heavy Atoms | 13 |
| Complexity | 223.0 |
| SMILES | CSC(=NC#N)SC1=CC=CC=C1 |
| InChIKey | DFCMEHPDGATCFE-UHFFFAOYSA-N |
Chemical Property Profile of [Methylsulfanyl(phenylsulfanyl)methylidene]cyanamide
Property Insights of [Methylsulfanyl(phenylsulfanyl)methylidene]cyanamide
The XLogP value of 3.5 indicates that [Methylsulfanyl(phenylsulfanyl)methylidene]cyanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.8 Ų falls within the moderate polarity range, balancing permeability and solubility for [Methylsulfanyl(phenylsulfanyl)methylidene]cyanamide. Following Lipinski's Rule of Five, [Methylsulfanyl(phenylsulfanyl)methylidene]cyanamide has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of [Methylsulfanyl(phenylsulfanyl)methylidene]cyanamide?
The CAS number of [Methylsulfanyl(phenylsulfanyl)methylidene]cyanamide is 152381-91-4.
What is the molecular formula of [Methylsulfanyl(phenylsulfanyl)methylidene]cyanamide?
The molecular formula of [Methylsulfanyl(phenylsulfanyl)methylidene]cyanamide is C9H8N2S2.
What is the molecular weight of [Methylsulfanyl(phenylsulfanyl)methylidene]cyanamide?
The molecular weight of [Methylsulfanyl(phenylsulfanyl)methylidene]cyanamide is 208.0129 g/mol.
Where can I buy [Methylsulfanyl(phenylsulfanyl)methylidene]cyanamide?
You can request a quote for [Methylsulfanyl(phenylsulfanyl)methylidene]cyanamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for [Methylsulfanyl(phenylsulfanyl)methylidene]cyanamide?
Yes, CoreyChem provides custom synthesis services for [Methylsulfanyl(phenylsulfanyl)methylidene]cyanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.