RefChem:138040
TL;DR: RefChem:138040 (CAS 65059-41-8) is a chemical compound with molecular formula C44H64Cl2N8O and molecular weight 790.46 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
triethyl-[2-[N-ethyl-4-[[4-[4-[[4-[ethyl-[2-(triethylazaniumyl)ethyl]amino]phenyl]diazenyl]phenoxy]phenyl]diazenyl]anilino]ethyl]azanium dichloride
Also Known As: Bis((2,2'-(oxybis(4,1-phenyleneazo-4,1-phenylene(ethylimino)))ethyl)triethylammonium) dichloride, 2,2'-{oxybis[benzene-4,1-diyl(e)diazene-2,1-diylbenzene-4,1-diyl(ethylimino)]}bis(n,n,n-triethylethanaminium) dichloride, Ethanaminium, 2,2'-(oxybis(4,1-phenylene-2,1-diazenediyl-4,1-phenylene(ethylimino)))bis(N,N,N-triethyl-, chloride (1:2), Ethanaminium, 2,2'-(oxybis(4,1-phenyleneazo-4,1-phenylene(ethylimino)))bis(N,N,N-triethyl-, dichloride, Ethanaminium, 2,2'-[oxybis[4,1-phenylene-2,1-diazenediyl-4,1-phenylene(ethylimino)]]bis[N,N,N-triethyl-, chloride (1:2)
| Molecular Formula | C44H64Cl2N8O |
|---|---|
| Molecular Weight | 790.46 g/mol |
| LogP | 5.72 |
| Topological Polar Surface Area | 65.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 22 |
| Exact Mass | 790.458 |
| Heavy Atoms | 55 |
| Complexity | 918.0 |
Chemical Identifiers
| CAS Number | 65059-41-8 |
|---|---|
| SMILES | CCN(CC[N+](CC)(CC)CC)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)OC3=CC=C(C=C3)N=NC4=CC=C(C=C4)N(CC)CC[N+](CC)(CC)CC.[Cl-].[Cl-] |
| InChIKey | XBEDKZXIVPYDGB-UHFFFAOYSA-L |
Product Overview
RefChem:138040 (CAS 65059-41-8), with molecular formula C44H64Cl2N8O and molecular weight 790.46 g/mol. IUPAC: triethyl-[2-[N-ethyl-4-[[4-[4-[[4-[ethyl-[2-(triethylazaniumyl)ethyl]amino]phenyl]diazenyl]phenoxy]phenyl]diazenyl]anilino]ethyl]azanium dichloride.
Chemical Property Profile of RefChem:138040
Property Insights of RefChem:138040
The XLogP value of 5.72 indicates that RefChem:138040 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.2 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:138040. Following Lipinski's Rule of Five, RefChem:138040 has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:138040?
The CAS number of RefChem:138040 is 65059-41-8.
What is the molecular formula of RefChem:138040?
The molecular formula of RefChem:138040 is C44H64Cl2N8O.
What is the molecular weight of RefChem:138040?
The molecular weight of RefChem:138040 is 790.46 g/mol.
Where can I buy RefChem:138040?
You can request a quote for RefChem:138040 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:138040?
Yes, KEHONG BIO provides custom synthesis services for RefChem:138040 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.