Dibrospidium Chloride
TL;DR: Dibrospidium Chloride (CAS 86641-76-1) is a chemical compound with molecular formula C18H32Br2Cl2N4O2 and molecular weight 564.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-1-[12-(3-bromopropanoyl)-3,12-diaza-6,9-diazoniadispiro[5.2.59.26]hexadecan-3-yl]propan-1-one dichloride
Also Known As: Dibrospidium Chloride, Spirobromin, spirobromine, Cloruro de dibrospidio, Dibrospidii chloridum
| Molecular Formula | C18H32Br2Cl2N4O2 |
|---|---|
| Molecular Weight | 564.03 g/mol |
| LogP | -5.1 |
| Topological Polar Surface Area | 40.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 566.02484 |
| Heavy Atoms | 28 |
| Complexity | 457.0 |
Chemical Identifiers
| CAS Number | 86641-76-1 |
|---|---|
| SMILES | C1C[N+]2(CCN1C(=O)CCBr)CC[N+]3(CCN(CC3)C(=O)CCBr)CC2.[Cl-].[Cl-] |
| InChIKey | CURYRIVJTBNEGU-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Dibrospidium Chloride (CAS 86641-76-1), with molecular formula C18H32Br2Cl2N4O2 and molecular weight 564.03 g/mol. IUPAC: 3-bromo-1-[12-(3-bromopropanoyl)-3,12-diaza-6,9-diazoniadispiro[5.2.59.26]hexadecan-3-yl]propan-1-one dichloride.
Chemical Property Profile of Dibrospidium Chloride
Property Insights of Dibrospidium Chloride
The XLogP value of -5.1 indicates that Dibrospidium Chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.6 Ų, Dibrospidium Chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibrospidium Chloride has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dibrospidium Chloride?
The CAS number of Dibrospidium Chloride is 86641-76-1.
What is the molecular formula of Dibrospidium Chloride?
The molecular formula of Dibrospidium Chloride is C18H32Br2Cl2N4O2.
What is the molecular weight of Dibrospidium Chloride?
The molecular weight of Dibrospidium Chloride is 564.03 g/mol.
Where can I buy Dibrospidium Chloride?
You can request a quote for Dibrospidium Chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dibrospidium Chloride?
Yes, KEHONG BIO provides custom synthesis services for Dibrospidium Chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.