RefChem:298112
TL;DR: RefChem:298112 (CAS 13073-18-2) is a chemical compound with molecular formula C36H54I2N4O2 and molecular weight 828.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(14-acetyl-1,10-dimethyl-7,16-diphenyl-5,14-diaza-1,10-diazoniatricyclo[14.2.2.27,10]docosan-5-yl)ethanone diiodide
Also Known As: I.S. 3360, 5,14-Diaza-1,10-diazoniatricyclo(14.2.2.2(sup 7,10))docosane, 5,14-diacetyl-1,10-dimethyl-7,16-diphenyl-, diiodide, 5,11-Diacetyl-1~1~,7~1~-dimethyl-1~4~,7~4~-diphenyl-5,11-diaza-1(1,4),7(4,1)-dipiperidinacyclododecaphane-1~1~,7~1~-diium diiodide, 5,14-Diacetyl-1,10-dimethyl-7,16-diphenyl-1,5,10,14-tetraazatricyclo[14.2.2.2~7,10~]docosane-1,10-diium diiodide
| Molecular Formula | C36H54I2N4O2 |
|---|---|
| Molecular Weight | 828.23 g/mol |
| LogP | -1.158 |
| Topological Polar Surface Area | 40.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 828.23364 |
| Heavy Atoms | 44 |
| Complexity | 831.0 |
Chemical Identifiers
| CAS Number | 13073-18-2 |
|---|---|
| SMILES | CC(=O)N1CCC[N+]2(CCC(CC2)(CN(CCC[N+]3(CCC(C1)(CC3)C4=CC=CC=C4)C)C(=O)C)C5=CC=CC=C5)C.[I-].[I-] |
| InChIKey | IAAQWPLSQMHGIR-UHFFFAOYSA-L |
Product Overview
RefChem:298112 (CAS 13073-18-2), with molecular formula C36H54I2N4O2 and molecular weight 828.23 g/mol. IUPAC: 1-(14-acetyl-1,10-dimethyl-7,16-diphenyl-5,14-diaza-1,10-diazoniatricyclo[14.2.2.27,10]docosan-5-yl)ethanone diiodide.
Chemical Property Profile of RefChem:298112
Property Insights of RefChem:298112
The XLogP value of -1.158 indicates that RefChem:298112 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.6 Ų, RefChem:298112 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:298112 has 0 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 RefChem:298112?
The CAS number of RefChem:298112 is 13073-18-2.
What is the molecular formula of RefChem:298112?
The molecular formula of RefChem:298112 is C36H54I2N4O2.
What is the molecular weight of RefChem:298112?
The molecular weight of RefChem:298112 is 828.23 g/mol.
Where can I buy RefChem:298112?
You can request a quote for RefChem:298112 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:298112?
Yes, KEHONG BIO provides custom synthesis services for RefChem:298112 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.