Pseudourea, 2,2'-((methylimino)diethylene)bis(2-thio-, trihydrobromide
TL;DR: Pseudourea, 2,2'-((methylimino)diethylene)bis(2-thio-, trihydrobromide (CAS 99670-03-8) is a chemical compound with molecular formula C7H20Br3N5S2 and molecular weight 474.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-carbamimidoylsulfanylethyl(methyl)amino]ethyl carbamimidothioate;trihydrobromide
Also Known As: S,2-Di(isothiuroniumethyl)methylamine dibromide hydrobromide, Pseudourea, 2,2'-((methylimino)diethylene)bis(2-thio-, trihydrobromide, 2,2'-((Methylimino)diethylene)bis(2-thiopseudourea) trihydrobromide, Pseudourea, 2,2'-((methylamino)diethylene)bis(2-thio-, trihydrobromide, (Methylazanediyl)di(ethane-2,1-diyl) dicarbamimidothioate--hydrogen bromide (1/3)
| Molecular Formula | C7H20Br3N5S2 |
|---|---|
| Molecular Weight | 474.87 g/mol |
| LogP | 1.90524 |
| Topological Polar Surface Area | 102.98 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 474.87103 |
| Heavy Atoms | 17 |
| Complexity | 187.94818 |
Chemical Identifiers
| CAS Number | 99670-03-8 |
|---|---|
| SMILES | CN(CCSC(=N)N)CCSC(=N)N.Br.Br.Br |
Product Overview
Pseudourea, 2,2'-((methylimino)diethylene)bis(2-thio-, trihydrobromide (CAS 99670-03-8), with molecular formula C7H20Br3N5S2 and molecular weight 474.87 g/mol. IUPAC: 2-[2-carbamimidoylsulfanylethyl(methyl)amino]ethyl carbamimidothioate;trihydrobromide.
Chemical Property Profile of Pseudourea, 2,2'-((methylimino)diethylene)bis(2-thio-, trihydrobromide
Property Insights of Pseudourea, 2,2'-((methylimino)diethylene)bis(2-thio-, trihydrobromide
The XLogP value of 1.90524 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pseudourea, 2,2'-((methylimino)diethylene)bis(2-thio-, trihydrobromide. The TPSA of 102.98 Ų falls within the moderate polarity range, balancing permeability and solubility for Pseudourea, 2,2'-((methylimino)diethylene)bis(2-thio-, trihydrobromide. Following Lipinski's Rule of Five, Pseudourea, 2,2'-((methylimino)diethylene)bis(2-thio-, trihydrobromide has 4 hydrogen bond donor(s) and 5 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 Pseudourea, 2,2'-((methylimino)diethylene)bis(2-thio-, trihydrobromide?
The CAS number of Pseudourea, 2,2'-((methylimino)diethylene)bis(2-thio-, trihydrobromide is 99670-03-8.
What is the molecular formula of Pseudourea, 2,2'-((methylimino)diethylene)bis(2-thio-, trihydrobromide?
The molecular formula of Pseudourea, 2,2'-((methylimino)diethylene)bis(2-thio-, trihydrobromide is C7H20Br3N5S2.
What is the molecular weight of Pseudourea, 2,2'-((methylimino)diethylene)bis(2-thio-, trihydrobromide?
The molecular weight of Pseudourea, 2,2'-((methylimino)diethylene)bis(2-thio-, trihydrobromide is 474.87 g/mol.
Where can I buy Pseudourea, 2,2'-((methylimino)diethylene)bis(2-thio-, trihydrobromide?
You can request a quote for Pseudourea, 2,2'-((methylimino)diethylene)bis(2-thio-, trihydrobromide 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'-((methylimino)diethylene)bis(2-thio-, trihydrobromide?
Yes, KEHONG BIO provides custom synthesis services for Pseudourea, 2,2'-((methylimino)diethylene)bis(2-thio-, trihydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.