Spirofylline
TL;DR: Spirofylline (CAS 98204-48-9) is a chemical compound with molecular formula C24H28N6O5 and molecular weight 480.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-7-[2-oxo-2-[2-oxo-8-(2-phenylethyl)-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]ethyl]purine-2,6-dione
Also Known As: Spirofylline, espirofilina, Spirofylline [INN], spirofyllinum, 1,3-dimethyl-7-[2-oxo-2- ethyl]purine-2,6-dione
| Molecular Formula | C24H28N6O5 |
|---|---|
| Molecular Weight | 480.21 g/mol |
| LogP | 0.4898 |
| Topological Polar Surface Area | 111.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 480.21213 |
| Heavy Atoms | 35 |
| Complexity | 1397.511 |
Chemical Identifiers
| CAS Number | 98204-48-9 |
|---|---|
| SMILES | CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CC(=O)N3CC4(CCN(CC4)CCC5=CC=CC=C5)OC3=O |
Product Overview
Spirofylline (CAS 98204-48-9), with molecular formula C24H28N6O5 and molecular weight 480.21 g/mol. IUPAC: 1,3-dimethyl-7-[2-oxo-2-[2-oxo-8-(2-phenylethyl)-1-oxa-3,8-diazaspiro[4.5]decan-3-yl]ethyl]purine-2,6-dione.
Chemical Property Profile of Spirofylline
Property Insights of Spirofylline
The XLogP value of 0.4898 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Spirofylline. The TPSA of 111.67 Ų falls within the moderate polarity range, balancing permeability and solubility for Spirofylline. Following Lipinski's Rule of Five, Spirofylline has 0 hydrogen bond donor(s) and 7 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 Spirofylline?
The CAS number of Spirofylline is 98204-48-9.
What is the molecular formula of Spirofylline?
The molecular formula of Spirofylline is C24H28N6O5.
What is the molecular weight of Spirofylline?
The molecular weight of Spirofylline is 480.21 g/mol.
Where can I buy Spirofylline?
You can request a quote for Spirofylline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Spirofylline?
Yes, KEHONG BIO provides custom synthesis services for Spirofylline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.