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Ammonium, hexamethylenebis(2-phenothiazin-10-ylethyl)dimethyl-, dibromide structure
Fine Chemical

Ammonium, hexamethylenebis(2-phenothiazin-10-ylethyl)dimethyl-, dibromide

TL;DR: Ammonium, hexamethylenebis(2-phenothiazin-10-ylethyl)dimethyl-, dibromide (CAS 63981-74-8) is a chemical compound with molecular formula C38H48Br2N4S2 and molecular weight 782.1687 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

6-[dimethyl(2-phenothiazin-10-ylethyl)azaniumyl]hexyl-dimethyl-(2-phenothiazin-10-ylethyl)azanium dibromide

Also Known As: Hexamethylenebis((beta-phenothiazin-10-yl)dimethylammonium bromide), AMMONIUM, HEXAMETHYLENEBIS(2-PHENOTHIAZIN-10-YLETHYL)DIMETHYL-, DIBROMIDE, 1,6-Hexanediaminium, N,N,N',N'-tetramethyl-N,N'-bis(2-(10H-phenothiazin-10-yl)ethyl)-, 2Br, 1,6-Hexanediaminium, N,N,N',N'-tetramethyl-N,N'-bis[2-(10H-phenothiazin-10-yl)ethyl]-, dibromide, 6-[dimethyl(2-phenothiazin-10-ylethyl)azaniumyl]hexyl-dimethyl-(2-phenothiazin-10-ylethyl)azanium dibromide

CAS Number
63981-74-8
Molecular Formula
C38H48Br2N4S2
Molecular Weight
782.1687 g/mol
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Technical Specifications

Molecular FormulaC38H48Br2N4S2
Molecular Weight782.1687 g/mol
XLogP3.31
Topological Polar Surface Area (TPSA)57.1 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors6
Rotatable Bonds13
Exact Mass784.1667 Da
Heavy Atoms46
Complexity767.0
SMILESC[N+](C)(CCCCCC[N+](C)(C)CCN1C2=CC=CC=C2SC3=CC=CC=C31)CCN4C5=CC=CC=C5SC6=CC=CC=C64.[Br-].[Br-]
InChIKeyUCXDVCFOPGOFBK-UHFFFAOYSA-L

Chemical Property Profile of Ammonium, hexamethylenebis(2-phenothiazin-10-ylethyl)dimethyl-, dibromide

XLogP
3.31
TPSA (Topological Polar Surface Area)
57.1
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
6
Rotatable Bonds
13
Heavy Atoms
46
Complexity
767.0
Exact Mass
784.1667
Monoisotopic Mass
782.1687
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 Ammonium, hexamethylenebis(2-phenothiazin-10-ylethyl)dimethyl-, dibromide

The XLogP value of 3.31 indicates that Ammonium, hexamethylenebis(2-phenothiazin-10-ylethyl)dimethyl-, dibromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.1 Ų, Ammonium, hexamethylenebis(2-phenothiazin-10-ylethyl)dimethyl-, dibromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, hexamethylenebis(2-phenothiazin-10-ylethyl)dimethyl-, dibromide has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the CAS number of Ammonium, hexamethylenebis(2-phenothiazin-10-ylethyl)dimethyl-, dibromide?

The CAS number of Ammonium, hexamethylenebis(2-phenothiazin-10-ylethyl)dimethyl-, dibromide is 63981-74-8.

What is the molecular formula of Ammonium, hexamethylenebis(2-phenothiazin-10-ylethyl)dimethyl-, dibromide?

The molecular formula of Ammonium, hexamethylenebis(2-phenothiazin-10-ylethyl)dimethyl-, dibromide is C38H48Br2N4S2.

What is the molecular weight of Ammonium, hexamethylenebis(2-phenothiazin-10-ylethyl)dimethyl-, dibromide?

The molecular weight of Ammonium, hexamethylenebis(2-phenothiazin-10-ylethyl)dimethyl-, dibromide is 782.1687 g/mol.

Where can I buy Ammonium, hexamethylenebis(2-phenothiazin-10-ylethyl)dimethyl-, dibromide?

You can request a quote for Ammonium, hexamethylenebis(2-phenothiazin-10-ylethyl)dimethyl-, dibromide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Ammonium, hexamethylenebis(2-phenothiazin-10-ylethyl)dimethyl-, dibromide?

Yes, CoreyChem provides custom synthesis services for Ammonium, hexamethylenebis(2-phenothiazin-10-ylethyl)dimethyl-, dibromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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