![[1-(2-Chloro-4-fluorobenzyl)-3-oxo-2-piperazinyl]acetic acid structure](/static/products/1043/1043445-75-5.webp)
[1-(2-Chloro-4-fluorobenzyl)-3-oxo-2-piperazinyl]acetic acid
TL;DR: [1-(2-Chloro-4-fluorobenzyl)-3-oxo-2-piperazinyl]acetic acid (CAS 1043445-75-5) is a chemical compound with molecular formula C13H14ClFN2O3 and molecular weight 300.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-[(2-chloro-4-fluorophenyl)methyl]-3-oxopiperazin-2-yl]acetic acid
Also Known As: AB01283464-01, [1-(2-chloro-4-fluorobenzyl)-3-oxo-2-piperazinyl]acetic acid, AN-329/43248808, 2-(1-(2-chloro-4-fluorobenzyl)-3-oxopiperazin-2-yl)acetic acid, [1-(2-chloro-4-fluorobenzyl)-3-oxopiperazin-2-yl]acetic acid
| Molecular Formula | C13H14ClFN2O3 |
|---|---|
| Molecular Weight | 300.07 g/mol |
| LogP | 1.2542 |
| Topological Polar Surface Area | 69.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 300.0677 |
| Heavy Atoms | 20 |
| Complexity | 538.3476 |
Chemical Identifiers
| CAS Number | 1043445-75-5 |
|---|---|
| SMILES | C1CN(C(C(=O)N1)CC(=O)O)CC2=C(C=C(C=C2)F)Cl |
Product Overview
[1-(2-Chloro-4-fluorobenzyl)-3-oxo-2-piperazinyl]acetic acid (CAS 1043445-75-5), with molecular formula C13H14ClFN2O3 and molecular weight 300.07 g/mol. IUPAC: 2-[1-[(2-chloro-4-fluorophenyl)methyl]-3-oxopiperazin-2-yl]acetic acid.
Chemical Property Profile of [1-(2-Chloro-4-fluorobenzyl)-3-oxo-2-piperazinyl]acetic acid
Property Insights of [1-(2-Chloro-4-fluorobenzyl)-3-oxo-2-piperazinyl]acetic acid
The XLogP value of 1.2542 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [1-(2-Chloro-4-fluorobenzyl)-3-oxo-2-piperazinyl]acetic acid. The TPSA of 69.64 Ų falls within the moderate polarity range, balancing permeability and solubility for [1-(2-Chloro-4-fluorobenzyl)-3-oxo-2-piperazinyl]acetic acid. Following Lipinski's Rule of Five, [1-(2-Chloro-4-fluorobenzyl)-3-oxo-2-piperazinyl]acetic acid has 2 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 [1-(2-Chloro-4-fluorobenzyl)-3-oxo-2-piperazinyl]acetic acid?
The CAS number of [1-(2-Chloro-4-fluorobenzyl)-3-oxo-2-piperazinyl]acetic acid is 1043445-75-5.
What is the molecular formula of [1-(2-Chloro-4-fluorobenzyl)-3-oxo-2-piperazinyl]acetic acid?
The molecular formula of [1-(2-Chloro-4-fluorobenzyl)-3-oxo-2-piperazinyl]acetic acid is C13H14ClFN2O3.
What is the molecular weight of [1-(2-Chloro-4-fluorobenzyl)-3-oxo-2-piperazinyl]acetic acid?
The molecular weight of [1-(2-Chloro-4-fluorobenzyl)-3-oxo-2-piperazinyl]acetic acid is 300.07 g/mol.
Where can I buy [1-(2-Chloro-4-fluorobenzyl)-3-oxo-2-piperazinyl]acetic acid?
You can request a quote for [1-(2-Chloro-4-fluorobenzyl)-3-oxo-2-piperazinyl]acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-(2-Chloro-4-fluorobenzyl)-3-oxo-2-piperazinyl]acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [1-(2-Chloro-4-fluorobenzyl)-3-oxo-2-piperazinyl]acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.