![2-[4-(3-Chlorophenyl)piperazine-1-carbonyl]benzoic acid structure](/static/products/841/841270-53-9.png)
2-[4-(3-Chlorophenyl)piperazine-1-carbonyl]benzoic acid
TL;DR: 2-[4-(3-Chlorophenyl)piperazine-1-carbonyl]benzoic acid (CAS 841270-53-9) is a chemical compound with molecular formula C18H17ClN2O3 and molecular weight 344.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(3-chlorophenyl)piperazine-1-carbonyl]benzoic acid
Also Known As: 2-[4-(3-chlorophenyl)piperazine-1-carbonyl]benzoic acid, ASN 08749169, 2-[4-(3-Chloro-phenyl)-piperazine-1-carbonyl]-benzoic acid
| Molecular Formula | C18H17ClN2O3 |
|---|---|
| Molecular Weight | 344.09 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 60.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 344.09277 |
| Heavy Atoms | 24 |
| Complexity | 465.0 |
Chemical Identifiers
| CAS Number | 841270-53-9 |
|---|---|
| SMILES | C1CN(CCN1C2=CC(=CC=C2)Cl)C(=O)C3=CC=CC=C3C(=O)O |
| InChIKey | ZEXMAJYUENLTBN-UHFFFAOYSA-N |
Product Overview
2-[4-(3-Chlorophenyl)piperazine-1-carbonyl]benzoic acid (CAS 841270-53-9), with molecular formula C18H17ClN2O3 and molecular weight 344.09 g/mol. IUPAC: 2-[4-(3-chlorophenyl)piperazine-1-carbonyl]benzoic acid.
Chemical Property Profile of 2-[4-(3-Chlorophenyl)piperazine-1-carbonyl]benzoic acid
Property Insights of 2-[4-(3-Chlorophenyl)piperazine-1-carbonyl]benzoic acid
The XLogP value of 3.1 indicates that 2-[4-(3-Chlorophenyl)piperazine-1-carbonyl]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[4-(3-Chlorophenyl)piperazine-1-carbonyl]benzoic acid. Following Lipinski's Rule of Five, 2-[4-(3-Chlorophenyl)piperazine-1-carbonyl]benzoic 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 2-[4-(3-Chlorophenyl)piperazine-1-carbonyl]benzoic acid?
The CAS number of 2-[4-(3-Chlorophenyl)piperazine-1-carbonyl]benzoic acid is 841270-53-9.
What is the molecular formula of 2-[4-(3-Chlorophenyl)piperazine-1-carbonyl]benzoic acid?
The molecular formula of 2-[4-(3-Chlorophenyl)piperazine-1-carbonyl]benzoic acid is C18H17ClN2O3.
What is the molecular weight of 2-[4-(3-Chlorophenyl)piperazine-1-carbonyl]benzoic acid?
The molecular weight of 2-[4-(3-Chlorophenyl)piperazine-1-carbonyl]benzoic acid is 344.09 g/mol.
Where can I buy 2-[4-(3-Chlorophenyl)piperazine-1-carbonyl]benzoic acid?
You can request a quote for 2-[4-(3-Chlorophenyl)piperazine-1-carbonyl]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[4-(3-Chlorophenyl)piperazine-1-carbonyl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-[4-(3-Chlorophenyl)piperazine-1-carbonyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.