![3-[4-(3-Chloro-phenyl)-piperazin-1-yl]-propionic acid structure](/static/products/1170/117017-83-1.webp)
3-[4-(3-Chloro-phenyl)-piperazin-1-yl]-propionic acid
TL;DR: 3-[4-(3-Chloro-phenyl)-piperazin-1-yl]-propionic acid (CAS 117017-83-1) is a chemical compound with molecular formula C13H17ClN2O2 and molecular weight 268.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(3-chlorophenyl)piperazin-1-yl]propanoic acid
Also Known As: 3-[4-(3-Chloro-phenyl)-piperazin-1-yl]-propionic acid, 3-[4-(3-chlorophenyl)piperazin-1-yl]propanoic acid, ASN 13259336, 3-[4-(3-chlorophenyl)piperazinyl]propanoic acid, AE-641/05538029
| Molecular Formula | C13H17ClN2O2 |
|---|---|
| Molecular Weight | 268.10 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 43.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 268.09787 |
| Heavy Atoms | 18 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 117017-83-1 |
|---|---|
| SMILES | C1CN(CCN1CCC(=O)O)C2=CC(=CC=C2)Cl |
| InChIKey | ZQJISGZTZQMABT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-[4-(3-Chloro-phenyl)-piperazin-1-yl]-propionic acid (CAS 117017-83-1), with molecular formula C13H17ClN2O2 and molecular weight 268.10 g/mol. IUPAC: 3-[4-(3-chlorophenyl)piperazin-1-yl]propanoic acid.
Chemical Property Profile of 3-[4-(3-Chloro-phenyl)-piperazin-1-yl]-propionic acid
Property Insights of 3-[4-(3-Chloro-phenyl)-piperazin-1-yl]-propionic acid
The XLogP value of -0.3 indicates that 3-[4-(3-Chloro-phenyl)-piperazin-1-yl]-propionic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 43.8 Ų, 3-[4-(3-Chloro-phenyl)-piperazin-1-yl]-propionic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[4-(3-Chloro-phenyl)-piperazin-1-yl]-propionic acid has 1 hydrogen bond donor(s) and 4 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-[4-(3-Chloro-phenyl)-piperazin-1-yl]-propionic acid?
The CAS number of 3-[4-(3-Chloro-phenyl)-piperazin-1-yl]-propionic acid is 117017-83-1.
What is the molecular formula of 3-[4-(3-Chloro-phenyl)-piperazin-1-yl]-propionic acid?
The molecular formula of 3-[4-(3-Chloro-phenyl)-piperazin-1-yl]-propionic acid is C13H17ClN2O2.
What is the molecular weight of 3-[4-(3-Chloro-phenyl)-piperazin-1-yl]-propionic acid?
The molecular weight of 3-[4-(3-Chloro-phenyl)-piperazin-1-yl]-propionic acid is 268.10 g/mol.
Where can I buy 3-[4-(3-Chloro-phenyl)-piperazin-1-yl]-propionic acid?
You can request a quote for 3-[4-(3-Chloro-phenyl)-piperazin-1-yl]-propionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[4-(3-Chloro-phenyl)-piperazin-1-yl]-propionic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[4-(3-Chloro-phenyl)-piperazin-1-yl]-propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.