Piberaline
TL;DR: Piberaline (CAS 39640-15-8) is a chemical compound with molecular formula C17H19N3O and molecular weight 281.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-benzylpiperazin-1-yl)-pyridin-2-ylmethanone
Also Known As: Piberaline, Piberalina, Piberalinum, Piberaline [INN], Trelibet
| Molecular Formula | C17H19N3O |
|---|---|
| Molecular Weight | 281.15 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 36.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 281.1528 |
| Heavy Atoms | 21 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 39640-15-8 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CC=CC=N3 |
| InChIKey | TZFUBYYADABEAV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Piberaline (CAS 39640-15-8), with molecular formula C17H19N3O and molecular weight 281.15 g/mol. IUPAC: (4-benzylpiperazin-1-yl)-pyridin-2-ylmethanone.
Chemical Property Profile of Piberaline
Property Insights of Piberaline
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piberaline. With a topological polar surface area (TPSA) of 36.4 Ų, Piberaline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piberaline has 0 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 Piberaline?
The CAS number of Piberaline is 39640-15-8.
What is the molecular formula of Piberaline?
The molecular formula of Piberaline is C17H19N3O.
What is the molecular weight of Piberaline?
The molecular weight of Piberaline is 281.15 g/mol.
Where can I buy Piberaline?
You can request a quote for Piberaline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Piberaline?
Yes, KEHONG BIO provides custom synthesis services for Piberaline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.