Guanidine, N,N'''-(dithiodi-2,1-ethanediyl)bis(N-phenyl-, dihydrobromide structure

Guanidine, N,N'''-(dithiodi-2,1-ethanediyl)bis(N-phenyl-, dihydrobromide

TL;DR: Guanidine, N,N'''-(dithiodi-2,1-ethanediyl)bis(N-phenyl-, dihydrobromide (CAS 16181-91-2) is a chemical compound with molecular formula C18H26Br2N6S2 and molecular weight 548.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

1-[2-[2-(N-carbamimidoylanilino)ethyldisulfanyl]ethyl]-1-phenylguanidine;dihydrobromide

Also Known As: Guanidine, N,N'''-(dithiodi-2,1-ethanediyl)bis(N-phenyl-, dihydrobromide, N,N'''-(Dithiodi-2,1-ethanediyl)bis(N-phenylguanidine) dihydrobromide, 1-[2-[2-(N-carbamimidoylanilino)ethyldisulfanyl]ethyl]-1-phenylguanidine dihydrobromide, N,N'-[Disulfanediyldi(ethane-2,1-diyl)]bis(N-phenylguanidine)--hydrogen bromide (1/2), RefChem:346998

CAS: 16181-91-2
Molecular Formula C18H26Br2N6S2
Molecular Weight 548.00 g/mol
LogP 4.32374
Topological Polar Surface Area 157.0 Ų
Hydrogen Bond Donors 6
Hydrogen Bond Acceptors 4
Rotatable Bonds 11
Exact Mass 548.0027
Heavy Atoms 28
Complexity 395.0

Chemical Identifiers

CAS Number 16181-91-2
SMILES C1=CC=C(C=C1)N(CCSSCCN(C2=CC=CC=C2)C(=N)N)C(=N)N.Br.Br
InChIKey OMFYDUPGLYIHFL-UHFFFAOYSA-N

Product Overview

Guanidine, N,N'''-(dithiodi-2,1-ethanediyl)bis(N-phenyl-, dihydrobromide (CAS 16181-91-2), with molecular formula C18H26Br2N6S2 and molecular weight 548.00 g/mol. IUPAC: 1-[2-[2-(N-carbamimidoylanilino)ethyldisulfanyl]ethyl]-1-phenylguanidine;dihydrobromide.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of Guanidine, N,N'''-(dithiodi-2,1-ethanediyl)bis(N-phenyl-, dihydrobromide

XLogP
4.32374
TPSA (Topological Polar Surface Area)
157.0
Hydrogen Bond Donors
6
Hydrogen Bond Acceptors
4
Rotatable Bonds
11
Heavy Atoms
28
Complexity
395.0
Exact Mass
548.0027
Monoisotopic Mass
548.0027
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Guanidine, N,N'''-(dithiodi-2,1-ethanediyl)bis(N-phenyl-, dihydrobromide

The XLogP value of 4.32374 indicates that Guanidine, N,N'''-(dithiodi-2,1-ethanediyl)bis(N-phenyl-, dihydrobromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 157.0 Ų indicates high polarity, suggesting Guanidine, N,N'''-(dithiodi-2,1-ethanediyl)bis(N-phenyl-, dihydrobromide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Guanidine, N,N'''-(dithiodi-2,1-ethanediyl)bis(N-phenyl-, 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 typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of Guanidine, N,N'''-(dithiodi-2,1-ethanediyl)bis(N-phenyl-, dihydrobromide?

The CAS number of Guanidine, N,N'''-(dithiodi-2,1-ethanediyl)bis(N-phenyl-, dihydrobromide is 16181-91-2.

What is the molecular formula of Guanidine, N,N'''-(dithiodi-2,1-ethanediyl)bis(N-phenyl-, dihydrobromide?

The molecular formula of Guanidine, N,N'''-(dithiodi-2,1-ethanediyl)bis(N-phenyl-, dihydrobromide is C18H26Br2N6S2.

What is the molecular weight of Guanidine, N,N'''-(dithiodi-2,1-ethanediyl)bis(N-phenyl-, dihydrobromide?

The molecular weight of Guanidine, N,N'''-(dithiodi-2,1-ethanediyl)bis(N-phenyl-, dihydrobromide is 548.00 g/mol.

Where can I buy Guanidine, N,N'''-(dithiodi-2,1-ethanediyl)bis(N-phenyl-, dihydrobromide?

You can request a quote for Guanidine, N,N'''-(dithiodi-2,1-ethanediyl)bis(N-phenyl-, dihydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for Guanidine, N,N'''-(dithiodi-2,1-ethanediyl)bis(N-phenyl-, dihydrobromide?

Yes, KEHONG BIO provides custom synthesis services for Guanidine, N,N'''-(dithiodi-2,1-ethanediyl)bis(N-phenyl-, dihydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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