(1,4-Phenylene)bis(methylene) dicarbamimidothioate--hydrogen chloride (1/2)
TL;DR: (1,4-Phenylene)bis(methylene) dicarbamimidothioate--hydrogen chloride (1/2) (CAS 10465-18-6) is a chemical compound with molecular formula C10H16Cl2N4S2 and molecular weight 326.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(carbamimidoylsulfanylmethyl)phenyl]methyl carbamimidothioate;dihydrochloride
Also Known As: 2,2'-(p-Phenylenedimethylene)bis(2-thiopseudourea) dihydrochloride, Pseudourea, 2,2'-(p-phenylenedimethylene)bis(2-thio-, dihydrochloride, alpha,alpha`-(p-XYLYLENE)bis ISOTHIURONIUM CHLORIDE, benzene-1,4-diyldimethanediyldicarbamimidothioate dihydrochloride, (1,4-Phenylene)bis(methylene) dicarbamimidothioate--hydrogen chloride (1/2)
| Molecular Formula | C10H16Cl2N4S2 |
|---|---|
| Molecular Weight | 326.02 g/mol |
| LogP | 2.78 |
| Topological Polar Surface Area | 150.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 326.01935 |
| Heavy Atoms | 18 |
| Complexity | 223.0 |
Chemical Identifiers
| CAS Number | 10465-18-6 |
|---|---|
| SMILES | C1=CC(=CC=C1CSC(=N)N)CSC(=N)N.Cl.Cl |
| InChIKey | DEUPPCUPAPJYGM-UHFFFAOYSA-N |
Product Overview
(1,4-Phenylene)bis(methylene) dicarbamimidothioate--hydrogen chloride (1/2) (CAS 10465-18-6), with molecular formula C10H16Cl2N4S2 and molecular weight 326.02 g/mol. IUPAC: [4-(carbamimidoylsulfanylmethyl)phenyl]methyl carbamimidothioate;dihydrochloride.
Chemical Property Profile of (1,4-Phenylene)bis(methylene) dicarbamimidothioate--hydrogen chloride (1/2)
Property Insights of (1,4-Phenylene)bis(methylene) dicarbamimidothioate--hydrogen chloride (1/2)
The XLogP value of 2.78 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1,4-Phenylene)bis(methylene) dicarbamimidothioate--hydrogen chloride (1/2). The TPSA of 150.0 Ų indicates high polarity, suggesting (1,4-Phenylene)bis(methylene) dicarbamimidothioate--hydrogen chloride (1/2) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (1,4-Phenylene)bis(methylene) dicarbamimidothioate--hydrogen chloride (1/2) has 6 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (1,4-Phenylene)bis(methylene) dicarbamimidothioate--hydrogen chloride (1/2)?
The CAS number of (1,4-Phenylene)bis(methylene) dicarbamimidothioate--hydrogen chloride (1/2) is 10465-18-6.
What is the molecular formula of (1,4-Phenylene)bis(methylene) dicarbamimidothioate--hydrogen chloride (1/2)?
The molecular formula of (1,4-Phenylene)bis(methylene) dicarbamimidothioate--hydrogen chloride (1/2) is C10H16Cl2N4S2.
What is the molecular weight of (1,4-Phenylene)bis(methylene) dicarbamimidothioate--hydrogen chloride (1/2)?
The molecular weight of (1,4-Phenylene)bis(methylene) dicarbamimidothioate--hydrogen chloride (1/2) is 326.02 g/mol.
Where can I buy (1,4-Phenylene)bis(methylene) dicarbamimidothioate--hydrogen chloride (1/2)?
You can request a quote for (1,4-Phenylene)bis(methylene) dicarbamimidothioate--hydrogen chloride (1/2) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1,4-Phenylene)bis(methylene) dicarbamimidothioate--hydrogen chloride (1/2)?
Yes, KEHONG BIO provides custom synthesis services for (1,4-Phenylene)bis(methylene) dicarbamimidothioate--hydrogen chloride (1/2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.