Acefilina piperazina
TL;DR: Acefilina piperazina (CAS 18833-13-1) is a chemical compound with molecular formula C22H30N10O8 and molecular weight 562.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis(2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetic acid);piperazine
Also Known As: Aethaphyllinium, Dynaphylline, Etaphylline, Etafillina, teozina
| Molecular Formula | C22H30N10O8 |
|---|---|
| Molecular Weight | 562.22 g/mol |
| LogP | -3.78 |
| Topological Polar Surface Area | 216.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 4 |
| Exact Mass | 562.2248 |
| Heavy Atoms | 40 |
| Complexity | 412.0 |
Chemical Identifiers
| CAS Number | 18833-13-1 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)O.CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)O.C1CNCCN1 |
| InChIKey | HAAJFUJFGYCCPU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Acefilina piperazina (CAS 18833-13-1), with molecular formula C22H30N10O8 and molecular weight 562.22 g/mol. IUPAC: bis(2-(1,3-dimethyl-2,6-dioxopurin-7-yl)acetic acid);piperazine.
Chemical Property Profile of Acefilina piperazina
Property Insights of Acefilina piperazina
The XLogP value of -3.78 indicates that Acefilina piperazina is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 216.0 Ų indicates high polarity, suggesting Acefilina piperazina may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Acefilina piperazina has 4 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Acefilina piperazina?
The CAS number of Acefilina piperazina is 18833-13-1.
What is the molecular formula of Acefilina piperazina?
The molecular formula of Acefilina piperazina is C22H30N10O8.
What is the molecular weight of Acefilina piperazina?
The molecular weight of Acefilina piperazina is 562.22 g/mol.
Where can I buy Acefilina piperazina?
You can request a quote for Acefilina piperazina directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acefilina piperazina?
Yes, KEHONG BIO provides custom synthesis services for Acefilina piperazina and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.