Pseudourea, 2,2'-thioethylenetrimethylenebis(thio-, dihydrochloride
TL;DR: Pseudourea, 2,2'-thioethylenetrimethylenebis(thio-, dihydrochloride (CAS 64058-47-5) is a chemical compound with molecular formula C7H18Cl2N4S3 and molecular weight 324.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-carbamimidoylsulfanylethylsulfanyl)propyl carbamimidothioate;dihydrochloride
Also Known As: USAF EL-71, 3-(2-(Isothioureido)ethyl thio)propyl isothiourea dihydrochloride, Pseudourea, 2,2'-thioethylenetrimethylenebis(thio-, dihydrochloride, Pseudourea, 3-(2-(isothioureido)ethylthio)propyl-2-thio, dihydrochloride, 3-{[2-(carbamimidoylsulfanyl)ethyl]sulfanyl}propyl carbamimidothioate dihydrochloride
| Molecular Formula | C7H18Cl2N4S3 |
|---|---|
| Molecular Weight | 324.01 g/mol |
| LogP | 2.21 |
| Topological Polar Surface Area | 176.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 324.00708 |
| Heavy Atoms | 16 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 64058-47-5 |
|---|---|
| SMILES | C(CSCCSC(=N)N)CSC(=N)N.Cl.Cl |
| InChIKey | KNAUSFFQLYBSHZ-UHFFFAOYSA-N |
Product Overview
Pseudourea, 2,2'-thioethylenetrimethylenebis(thio-, dihydrochloride (CAS 64058-47-5), with molecular formula C7H18Cl2N4S3 and molecular weight 324.01 g/mol. IUPAC: 3-(2-carbamimidoylsulfanylethylsulfanyl)propyl carbamimidothioate;dihydrochloride.
Chemical Property Profile of Pseudourea, 2,2'-thioethylenetrimethylenebis(thio-, dihydrochloride
Property Insights of Pseudourea, 2,2'-thioethylenetrimethylenebis(thio-, dihydrochloride
The XLogP value of 2.21 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pseudourea, 2,2'-thioethylenetrimethylenebis(thio-, dihydrochloride. The TPSA of 176.0 Ų indicates high polarity, suggesting Pseudourea, 2,2'-thioethylenetrimethylenebis(thio-, dihydrochloride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pseudourea, 2,2'-thioethylenetrimethylenebis(thio-, dihydrochloride has 6 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pseudourea, 2,2'-thioethylenetrimethylenebis(thio-, dihydrochloride?
The CAS number of Pseudourea, 2,2'-thioethylenetrimethylenebis(thio-, dihydrochloride is 64058-47-5.
What is the molecular formula of Pseudourea, 2,2'-thioethylenetrimethylenebis(thio-, dihydrochloride?
The molecular formula of Pseudourea, 2,2'-thioethylenetrimethylenebis(thio-, dihydrochloride is C7H18Cl2N4S3.
What is the molecular weight of Pseudourea, 2,2'-thioethylenetrimethylenebis(thio-, dihydrochloride?
The molecular weight of Pseudourea, 2,2'-thioethylenetrimethylenebis(thio-, dihydrochloride is 324.01 g/mol.
Where can I buy Pseudourea, 2,2'-thioethylenetrimethylenebis(thio-, dihydrochloride?
You can request a quote for Pseudourea, 2,2'-thioethylenetrimethylenebis(thio-, dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pseudourea, 2,2'-thioethylenetrimethylenebis(thio-, dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Pseudourea, 2,2'-thioethylenetrimethylenebis(thio-, dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.