[1,3-Benzothiazol-2-yloxymethylsulfanyl(methylsulfanyl)methylidene]cyanamide
TL;DR: [1,3-Benzothiazol-2-yloxymethylsulfanyl(methylsulfanyl)methylidene]cyanamide (CAS 353254-74-7) is a chemical compound with molecular formula C11H9N3OS3 and molecular weight 294.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1,3-benzothiazol-2-yloxymethylsulfanyl(methylsulfanyl)methylidene]cyanamide
Also Known As: [(benzo[d]thiazol-2-yloxy)methyl]methylcyanocarbonimidodithioate, [(benzo[d]thiazol-2-yloxy)methyl] methylcyanocarbonimidodithioate, [1,3-benzothiazol-2-yloxymethylsulfanyl(methylsulfanyl)methylidene]cyanamide, [ METHYL]METHYLCYANOCARBONIMIDODITHIOATE, AI-067/31569038
| Molecular Formula | C11H9N3OS3 |
|---|---|
| Molecular Weight | 294.99 g/mol |
| LogP | 3.56588 |
| Topological Polar Surface Area | 58.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 294.99078 |
| Heavy Atoms | 18 |
| Complexity | 569.8444 |
Chemical Identifiers
| CAS Number | 353254-74-7 |
|---|---|
| SMILES | CSC(=NC#N)SCOC1=NC2=CC=CC=C2S1 |
Product Overview
[1,3-Benzothiazol-2-yloxymethylsulfanyl(methylsulfanyl)methylidene]cyanamide (CAS 353254-74-7), with molecular formula C11H9N3OS3 and molecular weight 294.99 g/mol. IUPAC: [1,3-benzothiazol-2-yloxymethylsulfanyl(methylsulfanyl)methylidene]cyanamide.
Chemical Property Profile of [1,3-Benzothiazol-2-yloxymethylsulfanyl(methylsulfanyl)methylidene]cyanamide
Property Insights of [1,3-Benzothiazol-2-yloxymethylsulfanyl(methylsulfanyl)methylidene]cyanamide
The XLogP value of 3.56588 indicates that [1,3-Benzothiazol-2-yloxymethylsulfanyl(methylsulfanyl)methylidene]cyanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.27 Ų, [1,3-Benzothiazol-2-yloxymethylsulfanyl(methylsulfanyl)methylidene]cyanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [1,3-Benzothiazol-2-yloxymethylsulfanyl(methylsulfanyl)methylidene]cyanamide 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
Frequently Asked Questions
What is the CAS number of [1,3-Benzothiazol-2-yloxymethylsulfanyl(methylsulfanyl)methylidene]cyanamide?
The CAS number of [1,3-Benzothiazol-2-yloxymethylsulfanyl(methylsulfanyl)methylidene]cyanamide is 353254-74-7.
What is the molecular formula of [1,3-Benzothiazol-2-yloxymethylsulfanyl(methylsulfanyl)methylidene]cyanamide?
The molecular formula of [1,3-Benzothiazol-2-yloxymethylsulfanyl(methylsulfanyl)methylidene]cyanamide is C11H9N3OS3.
What is the molecular weight of [1,3-Benzothiazol-2-yloxymethylsulfanyl(methylsulfanyl)methylidene]cyanamide?
The molecular weight of [1,3-Benzothiazol-2-yloxymethylsulfanyl(methylsulfanyl)methylidene]cyanamide is 294.99 g/mol.
Where can I buy [1,3-Benzothiazol-2-yloxymethylsulfanyl(methylsulfanyl)methylidene]cyanamide?
You can request a quote for [1,3-Benzothiazol-2-yloxymethylsulfanyl(methylsulfanyl)methylidene]cyanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1,3-Benzothiazol-2-yloxymethylsulfanyl(methylsulfanyl)methylidene]cyanamide?
Yes, KEHONG BIO provides custom synthesis services for [1,3-Benzothiazol-2-yloxymethylsulfanyl(methylsulfanyl)methylidene]cyanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.