1-Benzoylpiperazine
TL;DR: 1-Benzoylpiperazine (CAS 39630-40-5) is a chemical compound with molecular formula C11H14N2O and molecular weight 190.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
phenyl(piperazin-1-yl)methanone
Also Known As: 1-Benzoylpiperazine, N-Benzoylpiperazine, phenyl(piperazin-1-yl)methanone, benzoylpiperazine, Piperazine, 1-benzoyl-
| Molecular Formula | C11H14N2O |
|---|---|
| Molecular Weight | 190.11 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 190.11061 |
| Heavy Atoms | 14 |
| Complexity | 193.0 |
Chemical Identifiers
| CAS Number | 39630-40-5 |
|---|---|
| SMILES | C1CN(CCN1)C(=O)C2=CC=CC=C2 |
| InChIKey | VUNXBQRNMNVUMV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Benzoylpiperazine (CAS 39630-40-5), with molecular formula C11H14N2O and molecular weight 190.11 g/mol. IUPAC: phenyl(piperazin-1-yl)methanone.
Chemical Property Profile of 1-Benzoylpiperazine
Property Insights of 1-Benzoylpiperazine
The XLogP value of -0.1 indicates that 1-Benzoylpiperazine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 32.3 Ų, 1-Benzoylpiperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzoylpiperazine has 1 hydrogen bond donor(s) and 2 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-Benzoylpiperazine?
The CAS number of 1-Benzoylpiperazine is 39630-40-5.
What is the molecular formula of 1-Benzoylpiperazine?
The molecular formula of 1-Benzoylpiperazine is C11H14N2O.
What is the molecular weight of 1-Benzoylpiperazine?
The molecular weight of 1-Benzoylpiperazine is 190.11 g/mol.
Where can I buy 1-Benzoylpiperazine?
You can request a quote for 1-Benzoylpiperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzoylpiperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzoylpiperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.