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2,4-Diazaspiro[5.5]undecane-1,3,5-trione
TL;DR: 2,4-Diazaspiro[5.5]undecane-1,3,5-trione (CAS 52-44-8) is a chemical compound with molecular formula C9H12N2O3 and molecular weight 196.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-diazaspiro[5.5]undecane-1,3,5-trione
Also Known As: 2,4-diazaspiro[5.5]undecane-1,3,5-trione, 2,4-DIAZASPIRO(5.5)UNDECANE-1,3,5-TRIONE, 5-24-09-00222 (Beilstein Handbook Reference), 8,10-diazaspiro[5.5]undecane-7,9,11-trione, Spiro[pyrimidine-5,1'-cyclohexane]-2,4,6(1H,3H,5H)-trione
| Molecular Formula | C9H12N2O3 |
|---|---|
| Molecular Weight | 196.08 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 75.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 196.0848 |
| Heavy Atoms | 14 |
| Complexity | 283.0 |
Chemical Identifiers
| CAS Number | 52-44-8 |
|---|---|
| SMILES | C1CCC2(CC1)C(=O)NC(=O)NC2=O |
| InChIKey | NBLIVIWUPTWDMD-UHFFFAOYSA-N |
Product Overview
2,4-Diazaspiro[5.5]undecane-1,3,5-trione (CAS 52-44-8), with molecular formula C9H12N2O3 and molecular weight 196.08 g/mol. IUPAC: 2,4-diazaspiro[5.5]undecane-1,3,5-trione.
Chemical Property Profile of 2,4-Diazaspiro[5.5]undecane-1,3,5-trione
Property Insights of 2,4-Diazaspiro[5.5]undecane-1,3,5-trione
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Diazaspiro[5.5]undecane-1,3,5-trione. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4-Diazaspiro[5.5]undecane-1,3,5-trione. Following Lipinski's Rule of Five, 2,4-Diazaspiro[5.5]undecane-1,3,5-trione has 2 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 2,4-Diazaspiro[5.5]undecane-1,3,5-trione?
The CAS number of 2,4-Diazaspiro[5.5]undecane-1,3,5-trione is 52-44-8.
What is the molecular formula of 2,4-Diazaspiro[5.5]undecane-1,3,5-trione?
The molecular formula of 2,4-Diazaspiro[5.5]undecane-1,3,5-trione is C9H12N2O3.
What is the molecular weight of 2,4-Diazaspiro[5.5]undecane-1,3,5-trione?
The molecular weight of 2,4-Diazaspiro[5.5]undecane-1,3,5-trione is 196.08 g/mol.
Where can I buy 2,4-Diazaspiro[5.5]undecane-1,3,5-trione?
You can request a quote for 2,4-Diazaspiro[5.5]undecane-1,3,5-trione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Diazaspiro[5.5]undecane-1,3,5-trione?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Diazaspiro[5.5]undecane-1,3,5-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.