7-Propyl-3-thio-2,4-diazaspiro(5.5)undecane-1,3,5-trione
TL;DR: 7-Propyl-3-thio-2,4-diazaspiro(5.5)undecane-1,3,5-trione (CAS 67196-35-4) is a chemical compound with molecular formula C12H18N2O2S and molecular weight 254.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11-propyl-3-sulfanylidene-2,4-diazaspiro[5.5]undecane-1,5-dione
Also Known As: 4-24-00-02024 (Beilstein Handbook Reference), 7-Propyl-3-thio-2,4-diazaspiro(5.5)undecane-1,3,5-trione, 2,4-Diazaspiro(5.5)undecane-1,3,5-trione, 7-propyl-3-thioxo-, 7-Propyl-3-thioxo-2,4-diazaspiro[5.5]undecane-1,5-dione, 2,4-Diazaspiro[5.5]undecane-1,5-dione, 7-propyl-3-thioxo-
| Molecular Formula | C12H18N2O2S |
|---|---|
| Molecular Weight | 254.11 g/mol |
| LogP | 1.494 |
| Topological Polar Surface Area | 58.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 254.1089 |
| Heavy Atoms | 17 |
| Complexity | 345.51712 |
Chemical Identifiers
| CAS Number | 67196-35-4 |
|---|---|
| SMILES | CCCC1CCCCC12C(=O)NC(=S)NC2=O |
Product Overview
7-Propyl-3-thio-2,4-diazaspiro(5.5)undecane-1,3,5-trione (CAS 67196-35-4), with molecular formula C12H18N2O2S and molecular weight 254.11 g/mol. IUPAC: 11-propyl-3-sulfanylidene-2,4-diazaspiro[5.5]undecane-1,5-dione.
Chemical Property Profile of 7-Propyl-3-thio-2,4-diazaspiro(5.5)undecane-1,3,5-trione
Property Insights of 7-Propyl-3-thio-2,4-diazaspiro(5.5)undecane-1,3,5-trione
The XLogP value of 1.494 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 7-Propyl-3-thio-2,4-diazaspiro(5.5)undecane-1,3,5-trione. With a topological polar surface area (TPSA) of 58.2 Ų, 7-Propyl-3-thio-2,4-diazaspiro(5.5)undecane-1,3,5-trione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 7-Propyl-3-thio-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 7-Propyl-3-thio-2,4-diazaspiro(5.5)undecane-1,3,5-trione?
The CAS number of 7-Propyl-3-thio-2,4-diazaspiro(5.5)undecane-1,3,5-trione is 67196-35-4.
What is the molecular formula of 7-Propyl-3-thio-2,4-diazaspiro(5.5)undecane-1,3,5-trione?
The molecular formula of 7-Propyl-3-thio-2,4-diazaspiro(5.5)undecane-1,3,5-trione is C12H18N2O2S.
What is the molecular weight of 7-Propyl-3-thio-2,4-diazaspiro(5.5)undecane-1,3,5-trione?
The molecular weight of 7-Propyl-3-thio-2,4-diazaspiro(5.5)undecane-1,3,5-trione is 254.11 g/mol.
Where can I buy 7-Propyl-3-thio-2,4-diazaspiro(5.5)undecane-1,3,5-trione?
You can request a quote for 7-Propyl-3-thio-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 7-Propyl-3-thio-2,4-diazaspiro(5.5)undecane-1,3,5-trione?
Yes, KEHONG BIO provides custom synthesis services for 7-Propyl-3-thio-2,4-diazaspiro(5.5)undecane-1,3,5-trione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.