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[1-(3-Fluoro-benzyl)-3-oxo-piperazin-2-yl]-acetic acid structure
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[1-(3-Fluoro-benzyl)-3-oxo-piperazin-2-yl]-acetic acid

TL;DR: [1-(3-Fluoro-benzyl)-3-oxo-piperazin-2-yl]-acetic acid (CAS 1033399-99-3) is a chemical compound with molecular formula C13H15FN2O3 and molecular weight 266.10666 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[1-[(3-fluorophenyl)methyl]-3-oxopiperazin-2-yl]acetic acid

Also Known As: [1-(3-Fluoro-benzyl)-3-oxo-piperazin-2-yl]-acetic acid|KS-00003ZWA|ASN 12361823|2-(1-(3-Fluorobenzyl)-3-oxopiperazin-2-yl)acetic acid|2-[1-[(3-fluorophenyl)methyl]-3-oxopiperazin-2-yl]acetic acid|[1-(3-fluorobenzyl)-3-oxo-2-piperazinyl]acetic acid|2-{1-[(3-fluorophenyl)methyl]-3-oxopiperazin-2-yl}acetic acid|AN-329/43219380|[1-(3-fluorobenzyl)-3-oxopiperazin-2-yl]acetic acid|{1-[(3-fluorophenyl)methyl]-3-oxopiperazin-2-yl}acetic acid|2-[1-[(3-fluorophenyl)methyl]-3-oxopiperazin-1-ium-2-yl]acetate|2-Piperazineacetic acid, 1-[(3-fluorophenyl)methyl]-3-oxo-|2-[1-[(3-fluorophenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]acetate|SBB012116|STK948030

CAS Number
1033399-99-3
Molecular Formula
C13H15FN2O3
Molecular Weight
266.10666 g/mol
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Technical Specifications

Molecular FormulaC13H15FN2O3
Molecular Weight266.10666 g/mol
XLogP-1.1
Topological Polar Surface Area (TPSA)73.7 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors4
Rotatable Bonds3
Exact Mass266.10666 Da
Heavy Atoms19
Complexity345.0
SMILESC1CN(C(C(=O)N1)CC(=O)O)CC2=CC(=CC=C2)F
InChIKeyLNUINKOTEGBAPP-UHFFFAOYSA-N

Chemical Property Profile of [1-(3-Fluoro-benzyl)-3-oxo-piperazin-2-yl]-acetic acid

XLogP
-1.1
TPSA (Topological Polar Surface Area)
73.7
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
3
Heavy Atoms
19
Complexity
345.0
Exact Mass
266.10666
Monoisotopic Mass
266.10666
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of [1-(3-Fluoro-benzyl)-3-oxo-piperazin-2-yl]-acetic acid

The XLogP value of -1.1 indicates that [1-(3-Fluoro-benzyl)-3-oxo-piperazin-2-yl]-acetic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 73.7 Ų falls within the moderate polarity range, balancing permeability and solubility for [1-(3-Fluoro-benzyl)-3-oxo-piperazin-2-yl]-acetic acid. Following Lipinski's Rule of Five, [1-(3-Fluoro-benzyl)-3-oxo-piperazin-2-yl]-acetic acid has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of [1-(3-Fluoro-benzyl)-3-oxo-piperazin-2-yl]-acetic acid?

The CAS number of [1-(3-Fluoro-benzyl)-3-oxo-piperazin-2-yl]-acetic acid is 1033399-99-3.

What is the molecular formula of [1-(3-Fluoro-benzyl)-3-oxo-piperazin-2-yl]-acetic acid?

The molecular formula of [1-(3-Fluoro-benzyl)-3-oxo-piperazin-2-yl]-acetic acid is C13H15FN2O3.

What is the molecular weight of [1-(3-Fluoro-benzyl)-3-oxo-piperazin-2-yl]-acetic acid?

The molecular weight of [1-(3-Fluoro-benzyl)-3-oxo-piperazin-2-yl]-acetic acid is 266.10666 g/mol.

Where can I buy [1-(3-Fluoro-benzyl)-3-oxo-piperazin-2-yl]-acetic acid?

You can request a quote for [1-(3-Fluoro-benzyl)-3-oxo-piperazin-2-yl]-acetic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for [1-(3-Fluoro-benzyl)-3-oxo-piperazin-2-yl]-acetic acid?

Yes, CoreyChem provides custom synthesis services for [1-(3-Fluoro-benzyl)-3-oxo-piperazin-2-yl]-acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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