5-(2-Ethylhexyl)-1,3,5-triazinane-2-thione
TL;DR: 5-(2-Ethylhexyl)-1,3,5-triazinane-2-thione (CAS 36933-50-3) is a chemical compound with molecular formula C11H23N3S and molecular weight 229.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(2-ethylhexyl)-1,3,5-triazinane-2-thione
Also Known As: 5-(2-ethylhexyl)-1,3,5-triazinane-2-thione, 5-(2-ethylhexyl)-1,3,5-triazaperhydroine-2-thione
| Molecular Formula | C11H23N3S |
|---|---|
| Molecular Weight | 229.16 g/mol |
| LogP | 1.8975 |
| Topological Polar Surface Area | 27.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 229.16127 |
| Heavy Atoms | 15 |
| Complexity | 186.27205 |
Chemical Identifiers
| CAS Number | 36933-50-3 |
|---|---|
| SMILES | CCCCC(CC)CN1CNC(=S)NC1 |
Product Overview
5-(2-Ethylhexyl)-1,3,5-triazinane-2-thione (CAS 36933-50-3), with molecular formula C11H23N3S and molecular weight 229.16 g/mol. IUPAC: 5-(2-ethylhexyl)-1,3,5-triazinane-2-thione.
Chemical Property Profile of 5-(2-Ethylhexyl)-1,3,5-triazinane-2-thione
Property Insights of 5-(2-Ethylhexyl)-1,3,5-triazinane-2-thione
The XLogP value of 1.8975 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(2-Ethylhexyl)-1,3,5-triazinane-2-thione. With a topological polar surface area (TPSA) of 27.3 Ų, 5-(2-Ethylhexyl)-1,3,5-triazinane-2-thione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(2-Ethylhexyl)-1,3,5-triazinane-2-thione has 2 hydrogen bond donor(s) and 2 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 5-(2-Ethylhexyl)-1,3,5-triazinane-2-thione?
The CAS number of 5-(2-Ethylhexyl)-1,3,5-triazinane-2-thione is 36933-50-3.
What is the molecular formula of 5-(2-Ethylhexyl)-1,3,5-triazinane-2-thione?
The molecular formula of 5-(2-Ethylhexyl)-1,3,5-triazinane-2-thione is C11H23N3S.
What is the molecular weight of 5-(2-Ethylhexyl)-1,3,5-triazinane-2-thione?
The molecular weight of 5-(2-Ethylhexyl)-1,3,5-triazinane-2-thione is 229.16 g/mol.
Where can I buy 5-(2-Ethylhexyl)-1,3,5-triazinane-2-thione?
You can request a quote for 5-(2-Ethylhexyl)-1,3,5-triazinane-2-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(2-Ethylhexyl)-1,3,5-triazinane-2-thione?
Yes, KEHONG BIO provides custom synthesis services for 5-(2-Ethylhexyl)-1,3,5-triazinane-2-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.