![[(1,3-Dioxoisoindol-2-yl)methylsulfanyl-methylsulfanylmethylidene]cyanamide structure](/static/products/845/845879-17-6.webp)
[(1,3-Dioxoisoindol-2-yl)methylsulfanyl-methylsulfanylmethylidene]cyanamide
TL;DR: [(1,3-Dioxoisoindol-2-yl)methylsulfanyl-methylsulfanylmethylidene]cyanamide (CAS 845879-17-6) is a chemical compound with molecular formula C12H9N3O2S2 and molecular weight 291.0136 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(1,3-dioxoisoindol-2-yl)methylsulfanyl-methylsulfanylmethylidene]cyanamide
Also Known As: AI-067/31569018, [(1,3-dioxoisoindol-2-yl)methylsulfanyl-methylsulfanylmethylidene]cyanamide, [(1,3-Dioxoisoindolin-2-yl)methyl] methyl cyanocarbonimidodithioate, [(1,3-dioxoisoindolin-2-yl)methyl] methylcyanocarbonimidodithioate, [(1,3-dioxoisoindolin-2-yl)methylsulfanyl-methylsulfanyl-methylene]cyanamide
Technical Specifications
| Molecular Formula | C12H9N3O2S2 |
| Molecular Weight | 291.0136 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 124.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 291.0136 Da |
| Heavy Atoms | 19 |
| Complexity | 445.0 |
| SMILES | CSC(=NC#N)SCN1C(=O)C2=CC=CC=C2C1=O |
| InChIKey | QOZOWFDJBFNNEL-UHFFFAOYSA-N |
Chemical Property Profile of [(1,3-Dioxoisoindol-2-yl)methylsulfanyl-methylsulfanylmethylidene]cyanamide
Property Insights of [(1,3-Dioxoisoindol-2-yl)methylsulfanyl-methylsulfanylmethylidene]cyanamide
The XLogP value of 3.3 indicates that [(1,3-Dioxoisoindol-2-yl)methylsulfanyl-methylsulfanylmethylidene]cyanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [(1,3-Dioxoisoindol-2-yl)methylsulfanyl-methylsulfanylmethylidene]cyanamide. Following Lipinski's Rule of Five, [(1,3-Dioxoisoindol-2-yl)methylsulfanyl-methylsulfanylmethylidene]cyanamide has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of [(1,3-Dioxoisoindol-2-yl)methylsulfanyl-methylsulfanylmethylidene]cyanamide?
The CAS number of [(1,3-Dioxoisoindol-2-yl)methylsulfanyl-methylsulfanylmethylidene]cyanamide is 845879-17-6.
What is the molecular formula of [(1,3-Dioxoisoindol-2-yl)methylsulfanyl-methylsulfanylmethylidene]cyanamide?
The molecular formula of [(1,3-Dioxoisoindol-2-yl)methylsulfanyl-methylsulfanylmethylidene]cyanamide is C12H9N3O2S2.
What is the molecular weight of [(1,3-Dioxoisoindol-2-yl)methylsulfanyl-methylsulfanylmethylidene]cyanamide?
The molecular weight of [(1,3-Dioxoisoindol-2-yl)methylsulfanyl-methylsulfanylmethylidene]cyanamide is 291.0136 g/mol.
Where can I buy [(1,3-Dioxoisoindol-2-yl)methylsulfanyl-methylsulfanylmethylidene]cyanamide?
You can request a quote for [(1,3-Dioxoisoindol-2-yl)methylsulfanyl-methylsulfanylmethylidene]cyanamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for [(1,3-Dioxoisoindol-2-yl)methylsulfanyl-methylsulfanylmethylidene]cyanamide?
Yes, CoreyChem provides custom synthesis services for [(1,3-Dioxoisoindol-2-yl)methylsulfanyl-methylsulfanylmethylidene]cyanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.