2,4-Diazaspiro(5.5)undecane-1,5-dione, 3-thioxo-
TL;DR: 2,4-Diazaspiro(5.5)undecane-1,5-dione, 3-thioxo- (CAS 52-45-9) is a chemical compound with molecular formula C9H12N2O2S and molecular weight 212.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-sulfanylidene-2,4-diazaspiro[5.5]undecane-1,5-dione
Also Known As: 3-Thioxo-2,4-diazaspiro(5.5)undecane-1,5-dione, Spiro(cyclohexane-2-thiobarbituric) acid, 2,4-DIAZASPIRO(5.5)UNDECANE-1,5-DIONE, 3-THIOXO-, 3-Thioxo-2,4-diazaspiro[5.5]undecane-1,5-dione, 5-24-09-00222 (Beilstein Handbook Reference)
| Molecular Formula | C9H12N2O2S |
|---|---|
| Molecular Weight | 212.06 g/mol |
| LogP | 0.4678 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 212.06195 |
| Heavy Atoms | 14 |
| Complexity | 285.9338 |
Chemical Identifiers
| CAS Number | 52-45-9 |
|---|---|
| SMILES | C1CCC2(CC1)C(=O)NC(=S)NC2=O |
Product Overview
2,4-Diazaspiro(5.5)undecane-1,5-dione, 3-thioxo- (CAS 52-45-9), with molecular formula C9H12N2O2S and molecular weight 212.06 g/mol. IUPAC: 3-sulfanylidene-2,4-diazaspiro[5.5]undecane-1,5-dione.
Chemical Property Profile of 2,4-Diazaspiro(5.5)undecane-1,5-dione, 3-thioxo-
Property Insights of 2,4-Diazaspiro(5.5)undecane-1,5-dione, 3-thioxo-
The XLogP value of 0.4678 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4-Diazaspiro(5.5)undecane-1,5-dione, 3-thioxo-. With a topological polar surface area (TPSA) of 58.2 Ų, 2,4-Diazaspiro(5.5)undecane-1,5-dione, 3-thioxo- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Diazaspiro(5.5)undecane-1,5-dione, 3-thioxo- 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-1,5-dione, 3-thioxo-?
The CAS number of 2,4-Diazaspiro(5.5)undecane-1,5-dione, 3-thioxo- is 52-45-9.
What is the molecular formula of 2,4-Diazaspiro(5.5)undecane-1,5-dione, 3-thioxo-?
The molecular formula of 2,4-Diazaspiro(5.5)undecane-1,5-dione, 3-thioxo- is C9H12N2O2S.
What is the molecular weight of 2,4-Diazaspiro(5.5)undecane-1,5-dione, 3-thioxo-?
The molecular weight of 2,4-Diazaspiro(5.5)undecane-1,5-dione, 3-thioxo- is 212.06 g/mol.
Where can I buy 2,4-Diazaspiro(5.5)undecane-1,5-dione, 3-thioxo-?
You can request a quote for 2,4-Diazaspiro(5.5)undecane-1,5-dione, 3-thioxo- 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-1,5-dione, 3-thioxo-?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Diazaspiro(5.5)undecane-1,5-dione, 3-thioxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.