Pseudourea, 2,2'-(o-phenylenedimethylene)bis(2-thio-, dihydrobromide
TL;DR: Pseudourea, 2,2'-(o-phenylenedimethylene)bis(2-thio-, dihydrobromide (CAS 16464-64-5) is a chemical compound with molecular formula C10H16Br2N4S2 and molecular weight 413.9183 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-(carbamimidoylsulfanylmethyl)phenyl]methyl carbamimidothioate;dihydrobromide
Also Known As: Diisothiuronium-o-xylylene dibromide, Pseudourea, 2,2'-(o-phenylenedimethylene)bis(2-thio-, dihydrobromide, 2,2'-(o-Phenylenedimethylene)bis(2-thiopseudourea) dihydrobromide, Carbamimidothioic acid, S,S'-(1,2-phenylenebis(methylene)) ester, dihydrobromide, (1,2-phenylene)bis(methylene) dicarbamimidothioate dihydrobromide
Technical Specifications
| Molecular Formula | C10H16Br2N4S2 |
| Molecular Weight | 413.9183 g/mol |
| XLogP | 3.09574 |
| Topological Polar Surface Area (TPSA) | 150.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.9183 Da |
| Heavy Atoms | 18 |
| Complexity | 231.0 |
| SMILES | C1=CC=C(C(=C1)CSC(=N)N)CSC(=N)N.Br.Br |
| InChIKey | CRPZKMZORZBOJH-UHFFFAOYSA-N |
Chemical Property Profile of Pseudourea, 2,2'-(o-phenylenedimethylene)bis(2-thio-, dihydrobromide
Property Insights of Pseudourea, 2,2'-(o-phenylenedimethylene)bis(2-thio-, dihydrobromide
The XLogP value of 3.09574 indicates that Pseudourea, 2,2'-(o-phenylenedimethylene)bis(2-thio-, dihydrobromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 150.0 Ų indicates high polarity, suggesting Pseudourea, 2,2'-(o-phenylenedimethylene)bis(2-thio-, dihydrobromide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pseudourea, 2,2'-(o-phenylenedimethylene)bis(2-thio-, dihydrobromide has 6 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Pseudourea, 2,2'-(o-phenylenedimethylene)bis(2-thio-, dihydrobromide?
The CAS number of Pseudourea, 2,2'-(o-phenylenedimethylene)bis(2-thio-, dihydrobromide is 16464-64-5.
What is the molecular formula of Pseudourea, 2,2'-(o-phenylenedimethylene)bis(2-thio-, dihydrobromide?
The molecular formula of Pseudourea, 2,2'-(o-phenylenedimethylene)bis(2-thio-, dihydrobromide is C10H16Br2N4S2.
What is the molecular weight of Pseudourea, 2,2'-(o-phenylenedimethylene)bis(2-thio-, dihydrobromide?
The molecular weight of Pseudourea, 2,2'-(o-phenylenedimethylene)bis(2-thio-, dihydrobromide is 413.9183 g/mol.
Where can I buy Pseudourea, 2,2'-(o-phenylenedimethylene)bis(2-thio-, dihydrobromide?
You can request a quote for Pseudourea, 2,2'-(o-phenylenedimethylene)bis(2-thio-, dihydrobromide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Pseudourea, 2,2'-(o-phenylenedimethylene)bis(2-thio-, dihydrobromide?
Yes, CoreyChem provides custom synthesis services for Pseudourea, 2,2'-(o-phenylenedimethylene)bis(2-thio-, dihydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.