Perbufylline
TL;DR: Perbufylline (CAS 110390-84-6) is a chemical compound with molecular formula C23H28FN5O3 and molecular weight 441.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-[4-[4-(4-fluorobenzoyl)piperidin-1-yl]butyl]-1,3-dimethylpurine-2,6-dione
Also Known As: Perbufylline, perbufilina, perbufyllinum, Perbufylline [INN], 7-[4-[4-(4-fluorobenzoyl)piperidin-1-yl]butyl]-1,3-dimethylpurine-2,6-dione
| Molecular Formula | C23H28FN5O3 |
|---|---|
| Molecular Weight | 441.22 g/mol |
| LogP | 1.9479 |
| Topological Polar Surface Area | 82.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 441.21762 |
| Heavy Atoms | 32 |
| Complexity | 1233.4808 |
Chemical Identifiers
| CAS Number | 110390-84-6 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCCN3CCC(CC3)C(=O)C4=CC=C(C=C4)F |
Product Overview
Perbufylline (CAS 110390-84-6), with molecular formula C23H28FN5O3 and molecular weight 441.22 g/mol. IUPAC: 7-[4-[4-(4-fluorobenzoyl)piperidin-1-yl]butyl]-1,3-dimethylpurine-2,6-dione.
Chemical Property Profile of Perbufylline
Property Insights of Perbufylline
The XLogP value of 1.9479 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Perbufylline. The TPSA of 82.13 Ų falls within the moderate polarity range, balancing permeability and solubility for Perbufylline. Following Lipinski's Rule of Five, Perbufylline has 0 hydrogen bond donor(s) and 5 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 Perbufylline?
The CAS number of Perbufylline is 110390-84-6.
What is the molecular formula of Perbufylline?
The molecular formula of Perbufylline is C23H28FN5O3.
What is the molecular weight of Perbufylline?
The molecular weight of Perbufylline is 441.22 g/mol.
Where can I buy Perbufylline?
You can request a quote for Perbufylline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Perbufylline?
Yes, KEHONG BIO provides custom synthesis services for Perbufylline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.