![[Benzylsulfanyl-[(2,5-dioxopyrrolidin-1-yl)methylsulfanyl]methylidene]cyanamide structure](/static/products/353/353254-68-9.png)
[Benzylsulfanyl-[(2,5-dioxopyrrolidin-1-yl)methylsulfanyl]methylidene]cyanamide
TL;DR: [Benzylsulfanyl-[(2,5-dioxopyrrolidin-1-yl)methylsulfanyl]methylidene]cyanamide (CAS 353254-68-9) is a chemical compound with molecular formula C14H13N3O2S2 and molecular weight 319.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[benzylsulfanyl-[(2,5-dioxopyrrolidin-1-yl)methylsulfanyl]methylidene]cyanamide
Also Known As: benzyl [(2,5-dioxopyrrolidin-1-yl)methyl]cyanocarbonimidodithioate, [benzylsulfanyl-[(2,5-dioxopyrrolidin-1-yl)methylsulfanyl]methylidene]cyanamide, BENZYL[ METHYL]CYANOCARBONIMIDODITHIOATE, AI-067/31569020, [(2,5-DIOXOPYRROLIDIN-1-YL)METHYL]CYANOCARBONIMIDO
| Molecular Formula | C14H13N3O2S2 |
|---|---|
| Molecular Weight | 319.04 g/mol |
| LogP | 2.59658 |
| Topological Polar Surface Area | 73.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 319.04492 |
| Heavy Atoms | 21 |
| Complexity | 579.98676 |
Chemical Identifiers
| CAS Number | 353254-68-9 |
|---|---|
| SMILES | C1CC(=O)N(C1=O)CSC(=NC#N)SCC2=CC=CC=C2 |
Product Overview
[Benzylsulfanyl-[(2,5-dioxopyrrolidin-1-yl)methylsulfanyl]methylidene]cyanamide (CAS 353254-68-9), with molecular formula C14H13N3O2S2 and molecular weight 319.04 g/mol. IUPAC: [benzylsulfanyl-[(2,5-dioxopyrrolidin-1-yl)methylsulfanyl]methylidene]cyanamide.
Chemical Property Profile of [Benzylsulfanyl-[(2,5-dioxopyrrolidin-1-yl)methylsulfanyl]methylidene]cyanamide
Property Insights of [Benzylsulfanyl-[(2,5-dioxopyrrolidin-1-yl)methylsulfanyl]methylidene]cyanamide
The XLogP value of 2.59658 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [Benzylsulfanyl-[(2,5-dioxopyrrolidin-1-yl)methylsulfanyl]methylidene]cyanamide. The TPSA of 73.53 Ų falls within the moderate polarity range, balancing permeability and solubility for [Benzylsulfanyl-[(2,5-dioxopyrrolidin-1-yl)methylsulfanyl]methylidene]cyanamide. Following Lipinski's Rule of Five, [Benzylsulfanyl-[(2,5-dioxopyrrolidin-1-yl)methylsulfanyl]methylidene]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
Frequently Asked Questions
What is the CAS number of [Benzylsulfanyl-[(2,5-dioxopyrrolidin-1-yl)methylsulfanyl]methylidene]cyanamide?
The CAS number of [Benzylsulfanyl-[(2,5-dioxopyrrolidin-1-yl)methylsulfanyl]methylidene]cyanamide is 353254-68-9.
What is the molecular formula of [Benzylsulfanyl-[(2,5-dioxopyrrolidin-1-yl)methylsulfanyl]methylidene]cyanamide?
The molecular formula of [Benzylsulfanyl-[(2,5-dioxopyrrolidin-1-yl)methylsulfanyl]methylidene]cyanamide is C14H13N3O2S2.
What is the molecular weight of [Benzylsulfanyl-[(2,5-dioxopyrrolidin-1-yl)methylsulfanyl]methylidene]cyanamide?
The molecular weight of [Benzylsulfanyl-[(2,5-dioxopyrrolidin-1-yl)methylsulfanyl]methylidene]cyanamide is 319.04 g/mol.
Where can I buy [Benzylsulfanyl-[(2,5-dioxopyrrolidin-1-yl)methylsulfanyl]methylidene]cyanamide?
You can request a quote for [Benzylsulfanyl-[(2,5-dioxopyrrolidin-1-yl)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 [Benzylsulfanyl-[(2,5-dioxopyrrolidin-1-yl)methylsulfanyl]methylidene]cyanamide?
Yes, KEHONG BIO provides custom synthesis services for [Benzylsulfanyl-[(2,5-dioxopyrrolidin-1-yl)methylsulfanyl]methylidene]cyanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.