2-(((3,5-Bis(acetylethylamino)-2,4,6-triiodobenzoyl)amino)methyl)butanoic acid
TL;DR: 2-(((3,5-Bis(acetylethylamino)-2,4,6-triiodobenzoyl)amino)methyl)butanoic acid (CAS 28920-89-0) is a chemical compound with molecular formula C20H26I3N3O5 and molecular weight 768.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[[3,5-bis[acetyl(ethyl)amino]-2,4,6-triiodobenzoyl]amino]methyl]butanoic acid
Also Known As: 2-(((3,5-Bis(acetylethylamino)-2,4,6-triiodobenzoyl)amino)methyl)butanoic acid, alpha-Aethyl-beta-(3,5-bis(N-aethyl-acetylamino)-2,4,6-triiod-benzoyl-amino)-propionsaure, Butanoic acid, 2-(((3,5-bis(acetylethylamino)-2,4,6-triiodobenzoyl)amino)methyl)-, 2-[[[3,5-bis[acetyl(ethyl)amino]-2,4,6-triiodobenzoyl]amino]methyl]butanoic acid, 2-({[{3,5-Bis[acetyl(ethyl)amino]-2,4,6-triiodophenyl}(hydroxy)methylidene]amino}methyl)butanoic acid
| Molecular Formula | C20H26I3N3O5 |
|---|---|
| Molecular Weight | 768.90 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 107.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 768.9007 |
| Heavy Atoms | 31 |
| Complexity | 644.0 |
Chemical Identifiers
| CAS Number | 28920-89-0 |
|---|---|
| SMILES | CCC(CNC(=O)C1=C(C(=C(C(=C1I)N(CC)C(=O)C)I)N(CC)C(=O)C)I)C(=O)O |
| InChIKey | PDTDFCGVQTWSSX-UHFFFAOYSA-N |
Product Overview
2-(((3,5-Bis(acetylethylamino)-2,4,6-triiodobenzoyl)amino)methyl)butanoic acid (CAS 28920-89-0), with molecular formula C20H26I3N3O5 and molecular weight 768.90 g/mol. IUPAC: 2-[[[3,5-bis[acetyl(ethyl)amino]-2,4,6-triiodobenzoyl]amino]methyl]butanoic acid.
Chemical Property Profile of 2-(((3,5-Bis(acetylethylamino)-2,4,6-triiodobenzoyl)amino)methyl)butanoic acid
Property Insights of 2-(((3,5-Bis(acetylethylamino)-2,4,6-triiodobenzoyl)amino)methyl)butanoic acid
The XLogP value of 3.0 indicates that 2-(((3,5-Bis(acetylethylamino)-2,4,6-triiodobenzoyl)amino)methyl)butanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(((3,5-Bis(acetylethylamino)-2,4,6-triiodobenzoyl)amino)methyl)butanoic acid. Following Lipinski's Rule of Five, 2-(((3,5-Bis(acetylethylamino)-2,4,6-triiodobenzoyl)amino)methyl)butanoic acid has 2 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 2-(((3,5-Bis(acetylethylamino)-2,4,6-triiodobenzoyl)amino)methyl)butanoic acid?
The CAS number of 2-(((3,5-Bis(acetylethylamino)-2,4,6-triiodobenzoyl)amino)methyl)butanoic acid is 28920-89-0.
What is the molecular formula of 2-(((3,5-Bis(acetylethylamino)-2,4,6-triiodobenzoyl)amino)methyl)butanoic acid?
The molecular formula of 2-(((3,5-Bis(acetylethylamino)-2,4,6-triiodobenzoyl)amino)methyl)butanoic acid is C20H26I3N3O5.
What is the molecular weight of 2-(((3,5-Bis(acetylethylamino)-2,4,6-triiodobenzoyl)amino)methyl)butanoic acid?
The molecular weight of 2-(((3,5-Bis(acetylethylamino)-2,4,6-triiodobenzoyl)amino)methyl)butanoic acid is 768.90 g/mol.
Where can I buy 2-(((3,5-Bis(acetylethylamino)-2,4,6-triiodobenzoyl)amino)methyl)butanoic acid?
You can request a quote for 2-(((3,5-Bis(acetylethylamino)-2,4,6-triiodobenzoyl)amino)methyl)butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(((3,5-Bis(acetylethylamino)-2,4,6-triiodobenzoyl)amino)methyl)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(((3,5-Bis(acetylethylamino)-2,4,6-triiodobenzoyl)amino)methyl)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.