2-(Octadecylthio)quinoline
TL;DR: 2-(Octadecylthio)quinoline (CAS 116967-22-7) is a chemical compound with molecular formula C27H43NS and molecular weight 413.3116 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-octadecylsulfanylquinoline
Also Known As: 2-(Octadecylthio)quinoline, 2-octadecylsulfanylquinoline, 2-(n-Octadecylthio)quinoline, 659-855-9
Technical Specifications
| Molecular Formula | C27H43NS |
| Molecular Weight | 413.3116 g/mol |
| XLogP | 11.9 |
| Topological Polar Surface Area (TPSA) | 38.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 18 |
| Exact Mass | 413.3116 Da |
| Heavy Atoms | 29 |
| Complexity | 358.0 |
| SMILES | CCCCCCCCCCCCCCCCCCSC1=NC2=CC=CC=C2C=C1 |
| InChIKey | DJBPSUZFRPSUEE-UHFFFAOYSA-N |
Chemical Property Profile of 2-(Octadecylthio)quinoline
Property Insights of 2-(Octadecylthio)quinoline
The XLogP value of 11.9 indicates that 2-(Octadecylthio)quinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.2 Ų, 2-(Octadecylthio)quinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Octadecylthio)quinoline has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 2-(Octadecylthio)quinoline?
The CAS number of 2-(Octadecylthio)quinoline is 116967-22-7.
What is the molecular formula of 2-(Octadecylthio)quinoline?
The molecular formula of 2-(Octadecylthio)quinoline is C27H43NS.
What is the molecular weight of 2-(Octadecylthio)quinoline?
The molecular weight of 2-(Octadecylthio)quinoline is 413.3116 g/mol.
Where can I buy 2-(Octadecylthio)quinoline?
You can request a quote for 2-(Octadecylthio)quinoline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(Octadecylthio)quinoline?
Yes, CoreyChem provides custom synthesis services for 2-(Octadecylthio)quinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.