Diiodoisoxsuprine
TL;DR: Diiodoisoxsuprine (CAS 25233-52-7) is a chemical compound with molecular formula C18H21I2NO3 and molecular weight 552.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[1-hydroxy-2-(1-phenoxypropan-2-ylamino)propyl]-2,6-diiodophenol
Also Known As: Diiodoisoxsuprine, 1-(3,5-Diiodo-4-hydroxyphenyl)-2-(1-methyl-2-phenoxyethylamino)propanol, 4-{1-hydroxy-2-[(1-phenoxypropan-2-yl)amino]propyl}-2,6-diiodophenol, 3,5-Diiodo-4-hydroxy-alpha-(1-((1-methyl-2-phenoxyethyl)amino)ethyl)benzyl alcohol, Benzyl alcohol, 3,5-diiodo-4-hydroxy-alpha-(1-((1-methyl-2-phenoxyethyl)amino)ethyl)-
| Molecular Formula | C18H21I2NO3 |
|---|---|
| Molecular Weight | 552.96 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 61.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 552.96106 |
| Heavy Atoms | 24 |
| Complexity | 356.0 |
Chemical Identifiers
| CAS Number | 25233-52-7 |
|---|---|
| SMILES | CC(COC1=CC=CC=C1)NC(C)C(C2=CC(=C(C(=C2)I)O)I)O |
| InChIKey | FTYFVLBOLZTEFT-UHFFFAOYSA-N |
Product Overview
Diiodoisoxsuprine (CAS 25233-52-7), with molecular formula C18H21I2NO3 and molecular weight 552.96 g/mol. IUPAC: 4-[1-hydroxy-2-(1-phenoxypropan-2-ylamino)propyl]-2,6-diiodophenol.
Chemical Property Profile of Diiodoisoxsuprine
Property Insights of Diiodoisoxsuprine
The XLogP value of 4.1 indicates that Diiodoisoxsuprine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Diiodoisoxsuprine. Following Lipinski's Rule of Five, Diiodoisoxsuprine has 3 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 Diiodoisoxsuprine?
The CAS number of Diiodoisoxsuprine is 25233-52-7.
What is the molecular formula of Diiodoisoxsuprine?
The molecular formula of Diiodoisoxsuprine is C18H21I2NO3.
What is the molecular weight of Diiodoisoxsuprine?
The molecular weight of Diiodoisoxsuprine is 552.96 g/mol.
Where can I buy Diiodoisoxsuprine?
You can request a quote for Diiodoisoxsuprine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diiodoisoxsuprine?
Yes, KEHONG BIO provides custom synthesis services for Diiodoisoxsuprine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.