Tyropanic Acid
TL;DR: Tyropanic Acid (CAS 27293-82-9) is a chemical compound with molecular formula C15H18I3NO3 and molecular weight 640.84 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-(butanoylamino)-2,4,6-triiodophenyl]methyl]butanoic acid
Also Known As: Tyropanoic acid, TYROPANIC ACID, tyropanoate, Acidum tyropanoicum, Tyropanoicacid
| Molecular Formula | C15H18I3NO3 |
|---|---|
| Molecular Weight | 640.84 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 640.8421 |
| Heavy Atoms | 22 |
| Complexity | 394.0 |
| Boiling Point | >187 |
| Solubility | slightly water soluble |
Chemical Identifiers
| CAS Number | 27293-82-9 |
|---|---|
| SMILES | CCCC(=O)NC1=C(C=C(C(=C1I)CC(CC)C(=O)O)I)I |
| InChIKey | YMOXVLQZFAUUKI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Tyropanic Acid (CAS 27293-82-9), with molecular formula C15H18I3NO3 and molecular weight 640.84 g/mol. IUPAC: 2-[[3-(butanoylamino)-2,4,6-triiodophenyl]methyl]butanoic acid.
Chemical Property Profile of Tyropanic Acid
Property Insights of Tyropanic Acid
The XLogP value of 4.6 indicates that Tyropanic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Tyropanic Acid. Following Lipinski's Rule of Five, Tyropanic Acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tyropanic Acid?
The CAS number of Tyropanic Acid is 27293-82-9.
What is the molecular formula of Tyropanic Acid?
The molecular formula of Tyropanic Acid is C15H18I3NO3.
What is the molecular weight of Tyropanic Acid?
The molecular weight of Tyropanic Acid is 640.84 g/mol.
Where can I buy Tyropanic Acid?
You can request a quote for Tyropanic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tyropanic Acid?
Yes, KEHONG BIO provides custom synthesis services for Tyropanic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.