Ioglicic Acid
TL;DR: Ioglicic Acid (CAS 49755-67-1) is a chemical compound with molecular formula C13H12I3N3O5 and molecular weight 670.79 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-acetamido-2,4,6-triiodo-5-[[2-(methylamino)-2-oxoethyl]carbamoyl]benzoic acid
Also Known As: Ioglicic acid, Acido ioglicico, Acide ioglicique, Acidum ioglicicum, ioglicicacid
| Molecular Formula | C13H12I3N3O5 |
|---|---|
| Molecular Weight | 670.79 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 125.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 670.7911 |
| Heavy Atoms | 24 |
| Complexity | 533.0 |
Chemical Identifiers
| CAS Number | 49755-67-1 |
|---|---|
| SMILES | CC(=O)NC1=C(C(=C(C(=C1I)C(=O)O)I)C(=O)NCC(=O)NC)I |
| InChIKey | HHFIATHHSBFCBY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ioglicic Acid (CAS 49755-67-1), with molecular formula C13H12I3N3O5 and molecular weight 670.79 g/mol. IUPAC: 3-acetamido-2,4,6-triiodo-5-[[2-(methylamino)-2-oxoethyl]carbamoyl]benzoic acid.
Chemical Property Profile of Ioglicic Acid
Property Insights of Ioglicic Acid
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ioglicic Acid. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ioglicic Acid. Following Lipinski's Rule of Five, Ioglicic Acid has 4 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 Ioglicic Acid?
The CAS number of Ioglicic Acid is 49755-67-1.
What is the molecular formula of Ioglicic Acid?
The molecular formula of Ioglicic Acid is C13H12I3N3O5.
What is the molecular weight of Ioglicic Acid?
The molecular weight of Ioglicic Acid is 670.79 g/mol.
Where can I buy Ioglicic Acid?
You can request a quote for Ioglicic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ioglicic Acid?
Yes, KEHONG BIO provides custom synthesis services for Ioglicic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.