![[6-(Octylsulfanyl)-9h-purin-9-yl]methanol structure](/static/products/1417/14172-55-5.webp)
[6-(Octylsulfanyl)-9h-purin-9-yl]methanol
TL;DR: [6-(Octylsulfanyl)-9h-purin-9-yl]methanol (CAS 14172-55-5) is a chemical compound with molecular formula C14H22N4OS and molecular weight 294.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-octylsulfanylpurin-9-yl)methanol
Also Known As: NCIOpen2_007101, [6-(octylsulfanyl)-9h-purin-9-yl]methanol, KST-1A1365, (6-octylsulfanylpurin-9-yl)methanol, (6-(Octylthio)-9H-purin-9-yl)methanol
| Molecular Formula | C14H22N4OS |
|---|---|
| Molecular Weight | 294.15 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 89.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 294.15143 |
| Heavy Atoms | 20 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 14172-55-5 |
|---|---|
| SMILES | CCCCCCCCSC1=NC=NC2=C1N=CN2CO |
| InChIKey | MWYHIWJIMBWASP-UHFFFAOYSA-N |
Product Overview
[6-(Octylsulfanyl)-9h-purin-9-yl]methanol (CAS 14172-55-5), with molecular formula C14H22N4OS and molecular weight 294.15 g/mol. IUPAC: (6-octylsulfanylpurin-9-yl)methanol.
Chemical Property Profile of [6-(Octylsulfanyl)-9h-purin-9-yl]methanol
Property Insights of [6-(Octylsulfanyl)-9h-purin-9-yl]methanol
The XLogP value of 3.9 indicates that [6-(Octylsulfanyl)-9h-purin-9-yl]methanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.1 Ų falls within the moderate polarity range, balancing permeability and solubility for [6-(Octylsulfanyl)-9h-purin-9-yl]methanol. Following Lipinski's Rule of Five, [6-(Octylsulfanyl)-9h-purin-9-yl]methanol has 1 hydrogen bond donor(s) and 5 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 [6-(Octylsulfanyl)-9h-purin-9-yl]methanol?
The CAS number of [6-(Octylsulfanyl)-9h-purin-9-yl]methanol is 14172-55-5.
What is the molecular formula of [6-(Octylsulfanyl)-9h-purin-9-yl]methanol?
The molecular formula of [6-(Octylsulfanyl)-9h-purin-9-yl]methanol is C14H22N4OS.
What is the molecular weight of [6-(Octylsulfanyl)-9h-purin-9-yl]methanol?
The molecular weight of [6-(Octylsulfanyl)-9h-purin-9-yl]methanol is 294.15 g/mol.
Where can I buy [6-(Octylsulfanyl)-9h-purin-9-yl]methanol?
You can request a quote for [6-(Octylsulfanyl)-9h-purin-9-yl]methanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [6-(Octylsulfanyl)-9h-purin-9-yl]methanol?
Yes, KEHONG BIO provides custom synthesis services for [6-(Octylsulfanyl)-9h-purin-9-yl]methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.