![4-Oxo-4-[2-(2-oxoimidazolidin-1-yl)ethylamino]but-2-enoic acid structure](/static/products/862/86218-08-8.png)
4-Oxo-4-[2-(2-oxoimidazolidin-1-yl)ethylamino]but-2-enoic acid
TL;DR: 4-Oxo-4-[2-(2-oxoimidazolidin-1-yl)ethylamino]but-2-enoic acid (CAS 86218-08-8) is a chemical compound with molecular formula C9H13N3O4 and molecular weight 227.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxo-4-[2-(2-oxoimidazolidin-1-yl)ethylamino]but-2-enoic acid
Also Known As: (Z)-3-[2-(2-oxoimidazolidin-1-yl)ethylcarbamoyl]prop-2-enoic acid
| Molecular Formula | C9H13N3O4 |
|---|---|
| Molecular Weight | 227.09 g/mol |
| LogP | -1.2314 |
| Topological Polar Surface Area | 98.74 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 227.0906 |
| Heavy Atoms | 16 |
| Complexity | 326.7158 |
Chemical Identifiers
| CAS Number | 86218-08-8 |
|---|---|
| SMILES | C1CN(C(=O)N1)CCNC(=O)C=CC(=O)O |
Product Overview
4-Oxo-4-[2-(2-oxoimidazolidin-1-yl)ethylamino]but-2-enoic acid (CAS 86218-08-8), with molecular formula C9H13N3O4 and molecular weight 227.09 g/mol. IUPAC: 4-oxo-4-[2-(2-oxoimidazolidin-1-yl)ethylamino]but-2-enoic acid.
Chemical Property Profile of 4-Oxo-4-[2-(2-oxoimidazolidin-1-yl)ethylamino]but-2-enoic acid
Property Insights of 4-Oxo-4-[2-(2-oxoimidazolidin-1-yl)ethylamino]but-2-enoic acid
The XLogP value of -1.2314 indicates that 4-Oxo-4-[2-(2-oxoimidazolidin-1-yl)ethylamino]but-2-enoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 98.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Oxo-4-[2-(2-oxoimidazolidin-1-yl)ethylamino]but-2-enoic acid. Following Lipinski's Rule of Five, 4-Oxo-4-[2-(2-oxoimidazolidin-1-yl)ethylamino]but-2-enoic acid has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-Oxo-4-[2-(2-oxoimidazolidin-1-yl)ethylamino]but-2-enoic acid?
The CAS number of 4-Oxo-4-[2-(2-oxoimidazolidin-1-yl)ethylamino]but-2-enoic acid is 86218-08-8.
What is the molecular formula of 4-Oxo-4-[2-(2-oxoimidazolidin-1-yl)ethylamino]but-2-enoic acid?
The molecular formula of 4-Oxo-4-[2-(2-oxoimidazolidin-1-yl)ethylamino]but-2-enoic acid is C9H13N3O4.
What is the molecular weight of 4-Oxo-4-[2-(2-oxoimidazolidin-1-yl)ethylamino]but-2-enoic acid?
The molecular weight of 4-Oxo-4-[2-(2-oxoimidazolidin-1-yl)ethylamino]but-2-enoic acid is 227.09 g/mol.
Where can I buy 4-Oxo-4-[2-(2-oxoimidazolidin-1-yl)ethylamino]but-2-enoic acid?
You can request a quote for 4-Oxo-4-[2-(2-oxoimidazolidin-1-yl)ethylamino]but-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Oxo-4-[2-(2-oxoimidazolidin-1-yl)ethylamino]but-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-Oxo-4-[2-(2-oxoimidazolidin-1-yl)ethylamino]but-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.