Squalene N-methylimine
TL;DR: Squalene N-methylimine (CAS 123453-64-5) is a chemical compound with molecular formula C28H47N and molecular weight 397.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E,8E,12E,16E)-N,4,8,13,17,21-hexamethyldocosa-4,8,12,16,20-pentaen-1-imine
Also Known As: Squalene N-methylimine, (4E,8E,12E,16E)-N,4,8,13,17,21-hexamethyldocosa-4,8,12,16,20-pentaen-1-imine, Methanamine, N-(4,8,13,17,21-pentamethyl-4,8,12,16,20-docosapentaenylidene)-, (E,?,E,E,E)-
| Molecular Formula | C28H47N |
|---|---|
| Molecular Weight | 397.37 g/mol |
| LogP | 9.3394 |
| Topological Polar Surface Area | 12.36 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 15 |
| Exact Mass | 397.37085 |
| Heavy Atoms | 29 |
| Complexity | 604.2251 |
Chemical Identifiers
| CAS Number | 123453-64-5 |
|---|---|
| SMILES | CC(=CCC/C(=C/CC/C(=C/CC/C=C(\C)/CC/C=C(\C)/CCC=NC)/C)/C)C |
Product Overview
Squalene N-methylimine (CAS 123453-64-5), with molecular formula C28H47N and molecular weight 397.37 g/mol. IUPAC: (4E,8E,12E,16E)-N,4,8,13,17,21-hexamethyldocosa-4,8,12,16,20-pentaen-1-imine.
Chemical Property Profile of Squalene N-methylimine
Property Insights of Squalene N-methylimine
The XLogP value of 9.3394 indicates that Squalene N-methylimine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.36 Ų, Squalene N-methylimine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Squalene N-methylimine has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Squalene N-methylimine?
The CAS number of Squalene N-methylimine is 123453-64-5.
What is the molecular formula of Squalene N-methylimine?
The molecular formula of Squalene N-methylimine is C28H47N.
What is the molecular weight of Squalene N-methylimine?
The molecular weight of Squalene N-methylimine is 397.37 g/mol.
Where can I buy Squalene N-methylimine?
You can request a quote for Squalene N-methylimine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Squalene N-methylimine?
Yes, KEHONG BIO provides custom synthesis services for Squalene N-methylimine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.