N-(3-(3-iodo-4-hydroxybenzyl)propionyl)-1,2-dipalmitoylphosphatidylethanolamine
TL;DR: N-(3-(3-iodo-4-hydroxybenzyl)propionyl)-1,2-dipalmitoylphosphatidylethanolamine (CAS 83016-61-9) is a chemical compound with molecular formula C46H81INO10P and molecular weight 963.46 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-hexadecanoyloxy-3-[hydroxy-[2-[3-(4-hydroxy-3-(125I)iodophenyl)propanoylamino]ethoxy]phosphoryl]oxypropyl] hexadecanoate
Also Known As: I-PP-PE, N-(3-(3-Iodo-4-hydroxybenzyl)propionyl)-1,2-dipalmitoyl-sn-glycero-3-phosphoethanolamine, N-(3-(3-Iodo-4-hydroxybenzyl)propionyl)-1,2-dipalmitoylphosphatidylethanolamine, [2-hexadecanoyloxy-3-[hydroxy-[2-[3-(4-hydroxy-3-(125I)iodanylphenyl)propanoylamino]ethoxy]phosphoryl]oxypropyl] hexadecanoate, [2-hexadecanoyloxy-3-[hydroxy-[2-[3-(4-hydroxy-3-iodanylphenyl)propanoylamino]ethoxy]phosphoryl]oxypropyl] hexadecanoate
| Molecular Formula | C46H81INO10P |
|---|---|
| Molecular Weight | 963.46 g/mol |
| LogP | 15.0 |
| Topological Polar Surface Area | 158.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 43 |
| Exact Mass | 963.4644 |
| Heavy Atoms | 59 |
| Complexity | 1080.0 |
Chemical Identifiers
| CAS Number | 83016-61-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OCC(COP(=O)(O)OCCNC(=O)CCC1=CC(=C(C=C1)O)[125I])OC(=O)CCCCCCCCCCCCCCC |
| InChIKey | ULAWVFAWOXHDKD-XYELRUNASA-N |
Product Overview
N-(3-(3-iodo-4-hydroxybenzyl)propionyl)-1,2-dipalmitoylphosphatidylethanolamine (CAS 83016-61-9), with molecular formula C46H81INO10P and molecular weight 963.46 g/mol. IUPAC: [2-hexadecanoyloxy-3-[hydroxy-[2-[3-(4-hydroxy-3-(125I)iodophenyl)propanoylamino]ethoxy]phosphoryl]oxypropyl] hexadecanoate.
Chemical Property Profile of N-(3-(3-iodo-4-hydroxybenzyl)propionyl)-1,2-dipalmitoylphosphatidylethanolamine
Property Insights of N-(3-(3-iodo-4-hydroxybenzyl)propionyl)-1,2-dipalmitoylphosphatidylethanolamine
The XLogP value of 15.0 indicates that N-(3-(3-iodo-4-hydroxybenzyl)propionyl)-1,2-dipalmitoylphosphatidylethanolamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 158.0 Ų indicates high polarity, suggesting N-(3-(3-iodo-4-hydroxybenzyl)propionyl)-1,2-dipalmitoylphosphatidylethanolamine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(3-(3-iodo-4-hydroxybenzyl)propionyl)-1,2-dipalmitoylphosphatidylethanolamine has 3 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(3-(3-iodo-4-hydroxybenzyl)propionyl)-1,2-dipalmitoylphosphatidylethanolamine?
The CAS number of N-(3-(3-iodo-4-hydroxybenzyl)propionyl)-1,2-dipalmitoylphosphatidylethanolamine is 83016-61-9.
What is the molecular formula of N-(3-(3-iodo-4-hydroxybenzyl)propionyl)-1,2-dipalmitoylphosphatidylethanolamine?
The molecular formula of N-(3-(3-iodo-4-hydroxybenzyl)propionyl)-1,2-dipalmitoylphosphatidylethanolamine is C46H81INO10P.
What is the molecular weight of N-(3-(3-iodo-4-hydroxybenzyl)propionyl)-1,2-dipalmitoylphosphatidylethanolamine?
The molecular weight of N-(3-(3-iodo-4-hydroxybenzyl)propionyl)-1,2-dipalmitoylphosphatidylethanolamine is 963.46 g/mol.
Where can I buy N-(3-(3-iodo-4-hydroxybenzyl)propionyl)-1,2-dipalmitoylphosphatidylethanolamine?
You can request a quote for N-(3-(3-iodo-4-hydroxybenzyl)propionyl)-1,2-dipalmitoylphosphatidylethanolamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-(3-iodo-4-hydroxybenzyl)propionyl)-1,2-dipalmitoylphosphatidylethanolamine?
Yes, KEHONG BIO provides custom synthesis services for N-(3-(3-iodo-4-hydroxybenzyl)propionyl)-1,2-dipalmitoylphosphatidylethanolamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.