RefChem:319427
TL;DR: RefChem:319427 (CAS 105000-09-7) is a chemical compound with molecular formula C28H43Cl3N4O2 and molecular weight 572.2452 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzyl-[2-[[2-[2-[(2-chlorophenyl)methyl-diethylazaniumyl]ethylamino]-2-oxoacetyl]amino]ethyl]-diethylazanium dichloride
Also Known As: Ammonium, N-benzyl-N'-(o-chlorobenzyl)-N,N'-(oxalylbis(iminoethylene))bis(N,N-diethyl-, dichloride, N-Benzyl-N'-(o-chlorobenzyl)-N,N'-(oxalylbis(iminoethylene))bis(N,N-diethylammonium chloride), 2-{[({2-[benzyl(diethyl)ammonio]ethyl}amino)(oxo)acetyl]amino}-n-(2-chlorobenzyl)-n,n-diethylethanaminium dichloride, benzyl-[2-[[2-[2-[(2-chlorophenyl)methyl-diethylazaniumyl]ethylamino]-2-oxoacetyl]amino]ethyl]-diethylazanium dichloride
Technical Specifications
| Molecular Formula | C28H43Cl3N4O2 |
| Molecular Weight | 572.2452 g/mol |
| XLogP | -2.01 |
| Topological Polar Surface Area (TPSA) | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 14 |
| Exact Mass | 572.2452 Da |
| Heavy Atoms | 37 |
| Complexity | 630.0 |
| SMILES | CC[N+](CC)(CCNC(=O)C(=O)NCC[N+](CC)(CC)CC1=CC=CC=C1Cl)CC2=CC=CC=C2.[Cl-].[Cl-] |
| InChIKey | XQOADIPNHCHZFN-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:319427
Property Insights of RefChem:319427
The XLogP value of -2.01 indicates that RefChem:319427 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 58.2 Ų, RefChem:319427 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:319427 has 2 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 RefChem:319427?
The CAS number of RefChem:319427 is 105000-09-7.
What is the molecular formula of RefChem:319427?
The molecular formula of RefChem:319427 is C28H43Cl3N4O2.
What is the molecular weight of RefChem:319427?
The molecular weight of RefChem:319427 is 572.2452 g/mol.
Where can I buy RefChem:319427?
You can request a quote for RefChem:319427 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:319427?
Yes, CoreyChem provides custom synthesis services for RefChem:319427 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.