Benzenmethanaminium, 3-((3-(bromomethyl)phenyl)azo)-N,N,N-trimethyl-
TL;DR: Benzenmethanaminium, 3-((3-(bromomethyl)phenyl)azo)-N,N,N-trimethyl- (CAS 38943-52-1) is a chemical compound with molecular formula C17H21Br2N3 and molecular weight 425.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-[[3-(bromomethyl)phenyl]diazenyl]phenyl]methyl-trimethylazanium bromide
Also Known As: cis-QBr, KST-1A4478, Benzenmethanaminium, 3-((3-(bromomethyl)phenyl)azo)-N,N,N-trimethyl-, (3-{(e)-[3-(bromomethyl)phenyl]diazenyl}phenyl)-n,n,n-trimethylmethanaminium bromide, [3-[[3-(bromomethyl)phenyl]diazenyl]phenyl]methyl-trimethylazanium;bromide
| Molecular Formula | C17H21Br2N3 |
|---|---|
| Molecular Weight | 425.01 g/mol |
| LogP | 2.2071 |
| Topological Polar Surface Area | 24.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 425.01022 |
| Heavy Atoms | 22 |
| Complexity | 337.0 |
Chemical Identifiers
| CAS Number | 38943-52-1 |
|---|---|
| SMILES | C[N+](C)(C)CC1=CC(=CC=C1)N=NC2=CC=CC(=C2)CBr.[Br-] |
| InChIKey | RHYQBUMSROZICI-UHFFFAOYSA-M |
Product Overview
Benzenmethanaminium, 3-((3-(bromomethyl)phenyl)azo)-N,N,N-trimethyl- (CAS 38943-52-1), with molecular formula C17H21Br2N3 and molecular weight 425.01 g/mol. IUPAC: [3-[[3-(bromomethyl)phenyl]diazenyl]phenyl]methyl-trimethylazanium bromide.
Chemical Property Profile of Benzenmethanaminium, 3-((3-(bromomethyl)phenyl)azo)-N,N,N-trimethyl-
Property Insights of Benzenmethanaminium, 3-((3-(bromomethyl)phenyl)azo)-N,N,N-trimethyl-
The XLogP value of 2.2071 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenmethanaminium, 3-((3-(bromomethyl)phenyl)azo)-N,N,N-trimethyl-. With a topological polar surface area (TPSA) of 24.7 Ų, Benzenmethanaminium, 3-((3-(bromomethyl)phenyl)azo)-N,N,N-trimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenmethanaminium, 3-((3-(bromomethyl)phenyl)azo)-N,N,N-trimethyl- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzenmethanaminium, 3-((3-(bromomethyl)phenyl)azo)-N,N,N-trimethyl-?
The CAS number of Benzenmethanaminium, 3-((3-(bromomethyl)phenyl)azo)-N,N,N-trimethyl- is 38943-52-1.
What is the molecular formula of Benzenmethanaminium, 3-((3-(bromomethyl)phenyl)azo)-N,N,N-trimethyl-?
The molecular formula of Benzenmethanaminium, 3-((3-(bromomethyl)phenyl)azo)-N,N,N-trimethyl- is C17H21Br2N3.
What is the molecular weight of Benzenmethanaminium, 3-((3-(bromomethyl)phenyl)azo)-N,N,N-trimethyl-?
The molecular weight of Benzenmethanaminium, 3-((3-(bromomethyl)phenyl)azo)-N,N,N-trimethyl- is 425.01 g/mol.
Where can I buy Benzenmethanaminium, 3-((3-(bromomethyl)phenyl)azo)-N,N,N-trimethyl-?
You can request a quote for Benzenmethanaminium, 3-((3-(bromomethyl)phenyl)azo)-N,N,N-trimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzenmethanaminium, 3-((3-(bromomethyl)phenyl)azo)-N,N,N-trimethyl-?
Yes, KEHONG BIO provides custom synthesis services for Benzenmethanaminium, 3-((3-(bromomethyl)phenyl)azo)-N,N,N-trimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.