![3-[2-(3-carboxyprop-2-enoylamino)ethylcarbamoyl]prop-2-enoic acid structure](/static/products/7126/7126-27-4.webp)
3-[2-(3-carboxyprop-2-enoylamino)ethylcarbamoyl]prop-2-enoic acid
TL;DR: 3-[2-(3-carboxyprop-2-enoylamino)ethylcarbamoyl]prop-2-enoic acid (CAS 7126-27-4) is a chemical compound with molecular formula C10H12N2O6 and molecular weight 256.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(3-carboxyprop-2-enoylamino)ethylamino]-4-oxobut-2-enoic acid
Also Known As: 3-[2-(3-carboxyprop-2-enoylamino)ethylcarbamoyl]prop-2-enoic acid, 4-[2-(3-carboxyprop-2-enoylamino)ethylamino]-4-oxobut-2-enoic acid, 4-[2-(3-carboxyprop-2-enoylamino)ethylamino]-4-oxo-but-2-enoic acid, (2Z)-3-({2-[(2Z)-3-carboxyprop-2-enamido]ethyl}carbamoyl)prop-2-enoic acid, 4-[2-[(4-hydroxy-4-oxobut-2-enoyl)amino]ethylamino]-4-oxobut-2-enoic acid
| Molecular Formula | C10H12N2O6 |
|---|---|
| Molecular Weight | 256.07 g/mol |
| LogP | -1.6 |
| Topological Polar Surface Area | 133.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 256.06955 |
| Heavy Atoms | 18 |
| Complexity | 361.0 |
Chemical Identifiers
| CAS Number | 7126-27-4 |
|---|---|
| SMILES | C(CNC(=O)C=CC(=O)O)NC(=O)C=CC(=O)O |
| InChIKey | OYNNHEMQCZQNEW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-[2-(3-carboxyprop-2-enoylamino)ethylcarbamoyl]prop-2-enoic acid (CAS 7126-27-4), with molecular formula C10H12N2O6 and molecular weight 256.07 g/mol. IUPAC: 4-[2-(3-carboxyprop-2-enoylamino)ethylamino]-4-oxobut-2-enoic acid.
Chemical Property Profile of 3-[2-(3-carboxyprop-2-enoylamino)ethylcarbamoyl]prop-2-enoic acid
Property Insights of 3-[2-(3-carboxyprop-2-enoylamino)ethylcarbamoyl]prop-2-enoic acid
The XLogP value of -1.6 indicates that 3-[2-(3-carboxyprop-2-enoylamino)ethylcarbamoyl]prop-2-enoic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 133.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[2-(3-carboxyprop-2-enoylamino)ethylcarbamoyl]prop-2-enoic acid. Following Lipinski's Rule of Five, 3-[2-(3-carboxyprop-2-enoylamino)ethylcarbamoyl]prop-2-enoic acid has 4 hydrogen bond donor(s) and 6 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 3-[2-(3-carboxyprop-2-enoylamino)ethylcarbamoyl]prop-2-enoic acid?
The CAS number of 3-[2-(3-carboxyprop-2-enoylamino)ethylcarbamoyl]prop-2-enoic acid is 7126-27-4.
What is the molecular formula of 3-[2-(3-carboxyprop-2-enoylamino)ethylcarbamoyl]prop-2-enoic acid?
The molecular formula of 3-[2-(3-carboxyprop-2-enoylamino)ethylcarbamoyl]prop-2-enoic acid is C10H12N2O6.
What is the molecular weight of 3-[2-(3-carboxyprop-2-enoylamino)ethylcarbamoyl]prop-2-enoic acid?
The molecular weight of 3-[2-(3-carboxyprop-2-enoylamino)ethylcarbamoyl]prop-2-enoic acid is 256.07 g/mol.
Where can I buy 3-[2-(3-carboxyprop-2-enoylamino)ethylcarbamoyl]prop-2-enoic acid?
You can request a quote for 3-[2-(3-carboxyprop-2-enoylamino)ethylcarbamoyl]prop-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 3-[2-(3-carboxyprop-2-enoylamino)ethylcarbamoyl]prop-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-(3-carboxyprop-2-enoylamino)ethylcarbamoyl]prop-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.