CTK4E8867
TL;DR: CTK4E8867 (CAS 22189-29-3) is a chemical compound with molecular formula C16H12I3NNa2O4 and molecular weight 708.77 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;2-amino-3-[3,5-diiodo-4-(3-iodo-4-oxidophenoxy)phenyl]-2-methylpropanoate
Also Known As: disodium 2-amino-3-[3,5-diiodo-4-(3-iodo-4-oxidophenoxy)phenyl]-2-methylpropanoate, 3-(4-(4-HYDROXY-3-IODOPHENOXY)-3,5-DIIODOPHENYL)2-METHYLALANINE DISODIUM HEXAHYD, D-Tyrosine, O-(4-hydroxy-3-iodophenyl)-3,5-diiodo-.alpha.-methyl-, disodium salt, hexahydrate, D-Tyrosine,O-(4-hydroxy-3-iodophenyl)-3,5-diiodo-a-methyl-, disodium salt, hexahydrate (9CI)
| Molecular Formula | C16H12I3NNa2O4 |
|---|---|
| Molecular Weight | 708.77 g/mol |
| LogP | -3.62 |
| Topological Polar Surface Area | 98.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 708.7696 |
| Heavy Atoms | 26 |
| Complexity | 438.0 |
Chemical Identifiers
| CAS Number | 22189-29-3 |
|---|---|
| SMILES | CC(CC1=CC(=C(C(=C1)I)OC2=CC(=C(C=C2)[O-])I)I)(C(=O)[O-])N.[Na+].[Na+] |
| InChIKey | AXIOAEOUOTYZJF-UHFFFAOYSA-L |
Product Overview
CTK4E8867 (CAS 22189-29-3), with molecular formula C16H12I3NNa2O4 and molecular weight 708.77 g/mol. IUPAC: disodium;2-amino-3-[3,5-diiodo-4-(3-iodo-4-oxidophenoxy)phenyl]-2-methylpropanoate.
Chemical Property Profile of CTK4E8867
Property Insights of CTK4E8867
The XLogP value of -3.62 indicates that CTK4E8867 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 98.4 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK4E8867. Following Lipinski's Rule of Five, CTK4E8867 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of CTK4E8867?
The CAS number of CTK4E8867 is 22189-29-3.
What is the molecular formula of CTK4E8867?
The molecular formula of CTK4E8867 is C16H12I3NNa2O4.
What is the molecular weight of CTK4E8867?
The molecular weight of CTK4E8867 is 708.77 g/mol.
Where can I buy CTK4E8867?
You can request a quote for CTK4E8867 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK4E8867?
Yes, KEHONG BIO provides custom synthesis services for CTK4E8867 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.