Toxiferine I, 18,18'-dideoxy-
TL;DR: Toxiferine I, 18,18'-dideoxy- (CAS 664-27-7) is a chemical compound with molecular formula C40H46N4+2 and molecular weight 582.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(9Z,25Z,28Z,38Z)-28,38-di(ethylidene)-14,30-dimethyl-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-octaene
Also Known As: Dihydrotoxiferin, Dihydrotoxiferine, C-Alkaloid K, Dihydrotoxiferin I, C-Dihydrotoxiferine
| Molecular Formula | C40H46N4+2 |
|---|---|
| Molecular Weight | 582.37 g/mol |
| LogP | 6.4184 |
| Topological Polar Surface Area | 6.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 582.37225 |
| Heavy Atoms | 44 |
| Complexity | 1682.8337 |
Chemical Identifiers
| CAS Number | 664-27-7 |
|---|---|
| SMILES | C/C=C\1/C2/C/3=C/N4C5=CC=CC=C5C67C4/C(=C\N8C3C9(C3=CC=CC=C83)C(C2)[N+](C1)(CC9)C)/C1/C(=C/C)/C[N+](C6C1)(CC7)C |
Product Overview
Toxiferine I, 18,18'-dideoxy- (CAS 664-27-7), with molecular formula C40H46N4+2 and molecular weight 582.37 g/mol. IUPAC: (9Z,25Z,28Z,38Z)-28,38-di(ethylidene)-14,30-dimethyl-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-octaene.
Chemical Property Profile of Toxiferine I, 18,18'-dideoxy-
Property Insights of Toxiferine I, 18,18'-dideoxy-
The XLogP value of 6.4184 indicates that Toxiferine I, 18,18'-dideoxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.48 Ų, Toxiferine I, 18,18'-dideoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Toxiferine I, 18,18'-dideoxy- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Toxiferine I, 18,18'-dideoxy-?
The CAS number of Toxiferine I, 18,18'-dideoxy- is 664-27-7.
What is the molecular formula of Toxiferine I, 18,18'-dideoxy-?
The molecular formula of Toxiferine I, 18,18'-dideoxy- is C40H46N4+2.
What is the molecular weight of Toxiferine I, 18,18'-dideoxy-?
The molecular weight of Toxiferine I, 18,18'-dideoxy- is 582.37 g/mol.
Where can I buy Toxiferine I, 18,18'-dideoxy-?
You can request a quote for Toxiferine I, 18,18'-dideoxy- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Toxiferine I, 18,18'-dideoxy-?
Yes, KEHONG BIO provides custom synthesis services for Toxiferine I, 18,18'-dideoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.