吞溴铵
TL;DR: 吞溴铵 (CAS 553-08-2) is a chemical compound with molecular formula C32H55BrN4O and molecular weight 590.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
吞溴铵
hexadecyl-[2-[(4-methoxyphenyl)methyl-pyrimidin-2-ylamino]ethyl]-dimethylazanium bromide
Also Known As: THONZONIUM BROMIDE, Thonzide, Tonzonium bromide, Thonzonium (bromide), Tonzonii bromidum
| Molecular Formula | C32H55BrN4O |
|---|---|
| Molecular Weight | 590.36 g/mol |
| LogP | 5.05 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 22 |
| Exact Mass | 590.3559 |
| Heavy Atoms | 38 |
| Complexity | 515.0 |
Chemical Identifiers
| CAS Number | 553-08-2 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC[N+](C)(C)CCN(CC1=CC=C(C=C1)OC)C2=NC=CC=N2.[Br-] |
| InChIKey | WBWDWFZTSDZAIG-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
吞溴铵 (CAS 553-08-2), with molecular formula C32H55BrN4O and molecular weight 590.36 g/mol. IUPAC: hexadecyl-[2-[(4-methoxyphenyl)methyl-pyrimidin-2-ylamino]ethyl]-dimethylazanium bromide.
Chemical Property Profile of 吞溴铵
Property Insights of 吞溴铵
The XLogP value of 5.05 indicates that 吞溴铵 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, 吞溴铵 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 吞溴铵 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 吞溴铵?
The CAS number of 吞溴铵 is 553-08-2.
What is the molecular formula of 吞溴铵?
The molecular formula of 吞溴铵 is C32H55BrN4O.
What is the molecular weight of 吞溴铵?
The molecular weight of 吞溴铵 is 590.36 g/mol.
Where can I buy 吞溴铵?
You can request a quote for 吞溴铵 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 吞溴铵?
Yes, KEHONG BIO provides custom synthesis services for 吞溴铵 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.