(4-Benzoylpiperazin-1-yl)acetic acid
TL;DR: (4-Benzoylpiperazin-1-yl)acetic acid (CAS 380656-44-0) is a chemical compound with molecular formula C13H16N2O3 and molecular weight 248.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-benzoylpiperazin-1-yl)acetic acid
Also Known As: 2-(4-benzoylpiperazin-1-yl)acetic Acid, 4-Benzoyl-1-piperazineacetic acid, (4-benzoyl-1-piperazinyl)acetic acid, (4-benzoylpiperazin-1-yl)acetic acid, AE-848/32733046
| Molecular Formula | C13H16N2O3 |
|---|---|
| Molecular Weight | 248.12 g/mol |
| LogP | 0.529 |
| Topological Polar Surface Area | 60.85 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 248.11609 |
| Heavy Atoms | 18 |
| Complexity | 425.1223 |
Chemical Identifiers
| CAS Number | 380656-44-0 |
|---|---|
| SMILES | C1CN(CCN1CC(=O)O)C(=O)C2=CC=CC=C2 |
Product Overview
(4-Benzoylpiperazin-1-yl)acetic acid (CAS 380656-44-0), with molecular formula C13H16N2O3 and molecular weight 248.12 g/mol. IUPAC: 2-(4-benzoylpiperazin-1-yl)acetic acid.
Chemical Property Profile of (4-Benzoylpiperazin-1-yl)acetic acid
Property Insights of (4-Benzoylpiperazin-1-yl)acetic acid
The XLogP value of 0.529 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (4-Benzoylpiperazin-1-yl)acetic acid. The TPSA of 60.85 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Benzoylpiperazin-1-yl)acetic acid. Following Lipinski's Rule of Five, (4-Benzoylpiperazin-1-yl)acetic acid has 1 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 (4-Benzoylpiperazin-1-yl)acetic acid?
The CAS number of (4-Benzoylpiperazin-1-yl)acetic acid is 380656-44-0.
What is the molecular formula of (4-Benzoylpiperazin-1-yl)acetic acid?
The molecular formula of (4-Benzoylpiperazin-1-yl)acetic acid is C13H16N2O3.
What is the molecular weight of (4-Benzoylpiperazin-1-yl)acetic acid?
The molecular weight of (4-Benzoylpiperazin-1-yl)acetic acid is 248.12 g/mol.
Where can I buy (4-Benzoylpiperazin-1-yl)acetic acid?
You can request a quote for (4-Benzoylpiperazin-1-yl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (4-Benzoylpiperazin-1-yl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (4-Benzoylpiperazin-1-yl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.