6-(Octadecylthio)purine
TL;DR: 6-(Octadecylthio)purine (CAS 122714-66-3) is a chemical compound with molecular formula C23H40N4S2 and molecular weight 436.26944 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-(octadecyldisulfanyl)-7H-purine
Also Known As: 6-(Octadecylthio)purine, 6-(octadecyldithio)purine, 6-(octadecyldisulfanyl)-7H-purine, 6-(Octadecyldisulfanyl)-9H-purine, 6-(Octadecyldithio)-1H-purine
Technical Specifications
| Molecular Formula | C23H40N4S2 |
| Molecular Weight | 436.26944 g/mol |
| XLogP | 9.8 |
| Topological Polar Surface Area (TPSA) | 105.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 19 |
| Exact Mass | 436.26944 Da |
| Heavy Atoms | 29 |
| Complexity | 373.0 |
| SMILES | CCCCCCCCCCCCCCCCCCSSC1=NC=NC2=C1NC=N2 |
| InChIKey | WDKYWEKURQNGMZ-UHFFFAOYSA-N |
Chemical Property Profile of 6-(Octadecylthio)purine
Property Insights of 6-(Octadecylthio)purine
The XLogP value of 9.8 indicates that 6-(Octadecylthio)purine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(Octadecylthio)purine. Following Lipinski's Rule of Five, 6-(Octadecylthio)purine has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 6-(Octadecylthio)purine?
The CAS number of 6-(Octadecylthio)purine is 122714-66-3.
What is the molecular formula of 6-(Octadecylthio)purine?
The molecular formula of 6-(Octadecylthio)purine is C23H40N4S2.
What is the molecular weight of 6-(Octadecylthio)purine?
The molecular weight of 6-(Octadecylthio)purine is 436.26944 g/mol.
Where can I buy 6-(Octadecylthio)purine?
You can request a quote for 6-(Octadecylthio)purine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-(Octadecylthio)purine?
Yes, CoreyChem provides custom synthesis services for 6-(Octadecylthio)purine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.