Alcuronium
TL;DR: Alcuronium (CAS 23214-96-2) is a chemical compound with molecular formula C44H50N4O2+2 and molecular weight 666.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(1S,9Z,11S,13S,17S,25Z,27S,33S,35S,36S)-38-(2-hydroxyethylidene)-14,30-bis(prop-2-enyl)-8,24-diaza-14,30-diazoniaundecacyclo[25.5.2.211,14.11,26.110,17.02,7.013,17.018,23.030,33.08,35.024,36]octatriaconta-2,4,6,9,18,20,22,25-octaen-28-ylidene]ethanol
Also Known As: Alcuronium, Alloferine, Alcuronum, Diallyltoxiferine, Alcuronium kation
| Molecular Formula | C44H50N4O2+2 |
|---|---|
| Molecular Weight | 666.39 g/mol |
| LogP | 5.4756 |
| Topological Polar Surface Area | 46.94 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 666.3934 |
| Heavy Atoms | 50 |
| Complexity | 1852.1763 |
Chemical Identifiers
| CAS Number | 23214-96-2 |
|---|---|
| SMILES | C=CC[N+]12[C@@H]3[C@]4(C5=CC=CC=C5N/6[C@H]4/C(=C\N7[C@H]8/C(=C6)/[C@@H]9C(=CCO)C[N+]4([C@H]([C@]8(C5=CC=CC=C75)CC4)C9)CC=C)/[C@@H](C3)C(=CCO)C1)CC2 |
Product Overview
Alcuronium (CAS 23214-96-2), with molecular formula C44H50N4O2+2 and molecular weight 666.39 g/mol. IUPAC: 2-[(1S,9Z,11S,13S,17S,25Z,27S,33S,35S,36S)-38-(2-hydroxyethylidene)-14,30-bis(prop-2-enyl)-8,24-diaza-14,30-diazoniaundecacyclo[25.5.2.211,14.11,26.110,17.02,7.013,17.018,23.030,33.08,35.024,36]octatriaconta-2,4,6,9,18,20,22,25-octaen-28-ylidene]ethanol.
Chemical Property Profile of Alcuronium
Property Insights of Alcuronium
The XLogP value of 5.4756 indicates that Alcuronium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.94 Ų, Alcuronium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Alcuronium has 2 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 Alcuronium?
The CAS number of Alcuronium is 23214-96-2.
What is the molecular formula of Alcuronium?
The molecular formula of Alcuronium is C44H50N4O2+2.
What is the molecular weight of Alcuronium?
The molecular weight of Alcuronium is 666.39 g/mol.
Where can I buy Alcuronium?
You can request a quote for Alcuronium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Alcuronium?
Yes, KEHONG BIO provides custom synthesis services for Alcuronium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.