1,4-Bis(2-carboxyethyl)piperazine
TL;DR: 1,4-Bis(2-carboxyethyl)piperazine (CAS 5649-49-0) is a chemical compound with molecular formula C10H18N2O4 and molecular weight 230.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(2-carboxyethyl)piperazin-1-yl]propanoic acid
Also Known As: 1,4-Bis(2-carboxyethyl)piperazine, 3,3'-(Piperazine-1,4-diyl)dipropanoic acid, 1,4-Bis piperazine, 3-[4-(2-carboxyethyl)piperazin-1-yl]propanoic acid, Piperazine-1,4-dipropionic acid
| Molecular Formula | C10H18N2O4 |
|---|---|
| Molecular Weight | 230.13 g/mol |
| LogP | -5.5 |
| Topological Polar Surface Area | 81.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 230.12666 |
| Heavy Atoms | 16 |
| Complexity | 223.0 |
Chemical Identifiers
| CAS Number | 5649-49-0 |
|---|---|
| SMILES | C1CN(CCN1CCC(=O)O)CCC(=O)O |
| InChIKey | WCJNJOOLQWJKLU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,4-Bis(2-carboxyethyl)piperazine (CAS 5649-49-0), with molecular formula C10H18N2O4 and molecular weight 230.13 g/mol. IUPAC: 3-[4-(2-carboxyethyl)piperazin-1-yl]propanoic acid.
Chemical Property Profile of 1,4-Bis(2-carboxyethyl)piperazine
Property Insights of 1,4-Bis(2-carboxyethyl)piperazine
The XLogP value of -5.5 indicates that 1,4-Bis(2-carboxyethyl)piperazine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 81.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Bis(2-carboxyethyl)piperazine. Following Lipinski's Rule of Five, 1,4-Bis(2-carboxyethyl)piperazine has 2 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 1,4-Bis(2-carboxyethyl)piperazine?
The CAS number of 1,4-Bis(2-carboxyethyl)piperazine is 5649-49-0.
What is the molecular formula of 1,4-Bis(2-carboxyethyl)piperazine?
The molecular formula of 1,4-Bis(2-carboxyethyl)piperazine is C10H18N2O4.
What is the molecular weight of 1,4-Bis(2-carboxyethyl)piperazine?
The molecular weight of 1,4-Bis(2-carboxyethyl)piperazine is 230.13 g/mol.
Where can I buy 1,4-Bis(2-carboxyethyl)piperazine?
You can request a quote for 1,4-Bis(2-carboxyethyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Bis(2-carboxyethyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Bis(2-carboxyethyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.