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[(4,6-dimethylpyrimidin-2-ylthio)methyl] methylcyanocarbonimidodithioate structure
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[(4,6-dimethylpyrimidin-2-ylthio)methyl] methylcyanocarbonimidodithioate

TL;DR: [(4,6-dimethylpyrimidin-2-ylthio)methyl] methylcyanocarbonimidodithioate (CAS 120958-21-6) is a chemical compound with molecular formula C10H12N4S3 and molecular weight 284.0224 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[(4,6-dimethylpyrimidin-2-yl)sulfanylmethylsulfanyl-methylsulfanylmethylidene]cyanamide

Also Known As: [(4,6-dimethylpyrimidin-2-ylthio)methyl] methylcyanocarbonimidodithioate|[(4,6-dimethylpyrimidin-2-yl)sulfanylmethylsulfanyl-methylsulfanylmethylidene]cyanamide|5-bromo-2-methyl-1,3-oxazole-4-carboxylic acid|[(4,6-Dimethylpyrimidin-2-ylthio)methyl] methyl cyanocarbonimidodithioate|[(4,6-dimethylpyrimidin-2-ylthio)methyl]methylcyanocarbonimidodithioate|AI-067/31569041|((4,6-Dimethylpyrimidin-2-yl)thio)methyl methyl cyanocarbonimidodithioate|[(4,6-dimethyl-2-pyrimidinyl)sulfanyl]methyl methyl cyanodithioimidocarbonate|[(4,6-Dimethylpyrimidin-2-yl)sulfanyl]methyl methyl cyanocarbonodithioimidate|MFCD06658010|DB-041592

CAS Number
120958-21-6
Molecular Formula
C10H12N4S3
Molecular Weight
284.0224 g/mol
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Technical Specifications

Molecular FormulaC10H12N4S3
Molecular Weight284.0224 g/mol
XLogP3.7
Topological Polar Surface Area (TPSA)138.0 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors7
Rotatable Bonds5
Exact Mass284.0224 Da
Heavy Atoms17
Complexity302.0
SMILESCC1=CC(=NC(=N1)SCSC(=NC#N)SC)C
InChIKeyXFILWIUYFBQEOA-UHFFFAOYSA-N

Chemical Property Profile of [(4,6-dimethylpyrimidin-2-ylthio)methyl] methylcyanocarbonimidodithioate

XLogP
3.7
TPSA (Topological Polar Surface Area)
138.0
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
7
Rotatable Bonds
5
Heavy Atoms
17
Complexity
302.0
Exact Mass
284.0224
Monoisotopic Mass
284.0224
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of [(4,6-dimethylpyrimidin-2-ylthio)methyl] methylcyanocarbonimidodithioate

The XLogP value of 3.7 indicates that [(4,6-dimethylpyrimidin-2-ylthio)methyl] methylcyanocarbonimidodithioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [(4,6-dimethylpyrimidin-2-ylthio)methyl] methylcyanocarbonimidodithioate. Following Lipinski's Rule of Five, [(4,6-dimethylpyrimidin-2-ylthio)methyl] methylcyanocarbonimidodithioate has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of [(4,6-dimethylpyrimidin-2-ylthio)methyl] methylcyanocarbonimidodithioate?

The CAS number of [(4,6-dimethylpyrimidin-2-ylthio)methyl] methylcyanocarbonimidodithioate is 120958-21-6.

What is the molecular formula of [(4,6-dimethylpyrimidin-2-ylthio)methyl] methylcyanocarbonimidodithioate?

The molecular formula of [(4,6-dimethylpyrimidin-2-ylthio)methyl] methylcyanocarbonimidodithioate is C10H12N4S3.

What is the molecular weight of [(4,6-dimethylpyrimidin-2-ylthio)methyl] methylcyanocarbonimidodithioate?

The molecular weight of [(4,6-dimethylpyrimidin-2-ylthio)methyl] methylcyanocarbonimidodithioate is 284.0224 g/mol.

Where can I buy [(4,6-dimethylpyrimidin-2-ylthio)methyl] methylcyanocarbonimidodithioate?

You can request a quote for [(4,6-dimethylpyrimidin-2-ylthio)methyl] methylcyanocarbonimidodithioate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for [(4,6-dimethylpyrimidin-2-ylthio)methyl] methylcyanocarbonimidodithioate?

Yes, CoreyChem provides custom synthesis services for [(4,6-dimethylpyrimidin-2-ylthio)methyl] methylcyanocarbonimidodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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