RefChem:1058821
TL;DR: RefChem:1058821 (CAS 73637-03-3) is a chemical compound with molecular formula C18H42Cl3N3O3 and molecular weight 453.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4,6-bis[2-(trimethylazaniumyl)ethyl]-1,3,5-trioxan-2-yl]ethyl-trimethylazanium trichloride
Also Known As: 2,4,6-Tris(beta-trimethylammoniumethyl)-s-trioxane trichloride, (s-Trioxane-2,4,6-triyltriethylene)tris(trimethylammonium) trichloride, 2-[4,6-bis[2-(trimethylazaniumyl)ethyl]-1,3,5-trioxan-2-yl]ethyl-trimethylazanium trichloride, AMMONIUM, (s-TRIOXANE-2,4,6-TRIYLTRIETHYLENE)TRIS(TRIMETHYL-, TRICHLORIDE, 2,2',2''-(1,3,5-Trioxane-2,4,6-triyl)tris(N,N,N-trimethylethan-1-aminium) trichloride
| Molecular Formula | C18H42Cl3N3O3 |
|---|---|
| Molecular Weight | 453.23 g/mol |
| LogP | -7.67 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 453.2292 |
| Heavy Atoms | 27 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 73637-03-3 |
|---|---|
| SMILES | C[N+](C)(C)CCC1OC(OC(O1)CC[N+](C)(C)C)CC[N+](C)(C)C.[Cl-].[Cl-].[Cl-] |
| InChIKey | CFGYJDVHAGJLSW-UHFFFAOYSA-K |
Product Overview
RefChem:1058821 (CAS 73637-03-3), with molecular formula C18H42Cl3N3O3 and molecular weight 453.23 g/mol. IUPAC: 2-[4,6-bis[2-(trimethylazaniumyl)ethyl]-1,3,5-trioxan-2-yl]ethyl-trimethylazanium trichloride.
Chemical Property Profile of RefChem:1058821
Property Insights of RefChem:1058821
The XLogP value of -7.67 indicates that RefChem:1058821 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 27.7 Ų, RefChem:1058821 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1058821 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1058821?
The CAS number of RefChem:1058821 is 73637-03-3.
What is the molecular formula of RefChem:1058821?
The molecular formula of RefChem:1058821 is C18H42Cl3N3O3.
What is the molecular weight of RefChem:1058821?
The molecular weight of RefChem:1058821 is 453.23 g/mol.
Where can I buy RefChem:1058821?
You can request a quote for RefChem:1058821 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1058821?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1058821 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.