BN 52205
TL;DR: BN 52205 (CAS 136533-71-6) is a chemical compound with molecular formula C28H61N2O5P and molecular weight 536.43 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-methoxy-2-[methyl(octadecyl)amino]propyl] 2-(trimethylazaniumyl)ethyl phosphate
Also Known As: BN 52205, 3,5-Dioxa-8-aza-4-phosphahexacosan-1-aminium, 4-hydroxy-7-(methoxymethyl)-N,N,N,8-tetramethyl-, hydroxide, inner salt, 4-oxide, [3-methoxy-2-[methyl(octadecyl)amino]propyl] 2-(trimethylazaniumyl)ethyl phosphate, 2-[[3-methoxy-2-(methyl-octadecyl-amino)propoxy]-oxido-phosphoryl]oxyethyl-trimethyl-azanium, 1-Propanol, dihydrogen phosphate, monoester with choline hydroxide,inner salt
| Molecular Formula | C28H61N2O5P |
|---|---|
| Molecular Weight | 536.43 g/mol |
| LogP | 7.7 |
| Topological Polar Surface Area | 71.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 27 |
| Exact Mass | 536.4318 |
| Heavy Atoms | 36 |
| Complexity | 522.0 |
Chemical Identifiers
| CAS Number | 136533-71-6 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCN(C)C(COC)COP(=O)([O-])OCC[N+](C)(C)C |
| InChIKey | QISJQFBOXNKZNQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
BN 52205 (CAS 136533-71-6), with molecular formula C28H61N2O5P and molecular weight 536.43 g/mol. IUPAC: [3-methoxy-2-[methyl(octadecyl)amino]propyl] 2-(trimethylazaniumyl)ethyl phosphate.
Chemical Property Profile of BN 52205
Property Insights of BN 52205
The XLogP value of 7.7 indicates that BN 52205 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for BN 52205. Following Lipinski's Rule of Five, BN 52205 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BN 52205?
The CAS number of BN 52205 is 136533-71-6.
What is the molecular formula of BN 52205?
The molecular formula of BN 52205 is C28H61N2O5P.
What is the molecular weight of BN 52205?
The molecular weight of BN 52205 is 536.43 g/mol.
Where can I buy BN 52205?
You can request a quote for BN 52205 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BN 52205?
Yes, KEHONG BIO provides custom synthesis services for BN 52205 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.