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RefChem:318933 structure
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RefChem:318933

TL;DR: RefChem:318933 (CAS 101015-22-9) is a chemical compound with molecular formula C21H38I2N4O2 and molecular weight 632.1084 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

[2-[3-[[2-[diethyl(methyl)azaniumyl]acetyl]amino]-4-methylanilino]-2-oxoethyl]-diethyl-methylazanium diiodide

Also Known As: Ammonium, (4-methyl-m-phenylenebis(iminocarbonylmethylene))bis(diethylmethyl-, diiodide, (4-Methyl-m-phenylenebis(iminocarbonylmethylene))bis(diethylmethylammonium iodide), 2,2'-[(4-methylbenzene-1,3-diyl)diimino]bis(n,n-diethyl-n-methyl-2-oxoethanaminium) diiodide, [2-[3-[[2-[diethyl(methyl)azaniumyl]acetyl]amino]-4-methylanilino]-2-oxoethyl]-diethyl-methylazanium;diiodide, [2-[3-[[2-[diethyl(methyl)azaniumyl]acetyl]amino]-4-methylanilino]-2-oxoethyl]-diethyl-methylazanium

CAS Number
101015-22-9
Molecular Formula
C21H38I2N4O2
Molecular Weight
632.1084 g/mol
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Technical Specifications

Molecular FormulaC21H38I2N4O2
Molecular Weight632.1084 g/mol
XLogP-3.15
Topological Polar Surface Area (TPSA)58.2 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors4
Rotatable Bonds10
Exact Mass632.1084 Da
Heavy Atoms29
Complexity487.0
SMILESCC[N+](C)(CC)CC(=O)NC1=CC(=C(C=C1)C)NC(=O)C[N+](C)(CC)CC.[I-].[I-]
InChIKeyXSBLQPYMMGTGKH-UHFFFAOYSA-N

Chemical Property Profile of RefChem:318933

XLogP
-3.15
TPSA (Topological Polar Surface Area)
58.2
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
10
Heavy Atoms
29
Complexity
487.0
Exact Mass
632.1084
Monoisotopic Mass
632.1084
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 RefChem:318933

The XLogP value of -3.15 indicates that RefChem:318933 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:318933 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:318933 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:318933?

The CAS number of RefChem:318933 is 101015-22-9.

What is the molecular formula of RefChem:318933?

The molecular formula of RefChem:318933 is C21H38I2N4O2.

What is the molecular weight of RefChem:318933?

The molecular weight of RefChem:318933 is 632.1084 g/mol.

Where can I buy RefChem:318933?

You can request a quote for RefChem:318933 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for RefChem:318933?

Yes, CoreyChem provides custom synthesis services for RefChem:318933 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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