6-(Pentylthio)purine
TL;DR: 6-(Pentylthio)purine (CAS 5443-89-0) is a chemical compound with molecular formula C10H14N4S and molecular weight 222.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-pentylsulfanyl-7H-purine
Also Known As: 6-(Pentylthio)purine, 6-Amylmercaptopurine, 6-(Pentylthio)-1H-purine, 6-n-Amylmercaptopurine, 1H-Purine, 6-(pentylthio)-
| Molecular Formula | C10H14N4S |
|---|---|
| Molecular Weight | 222.09 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 79.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 222.09392 |
| Heavy Atoms | 15 |
| Complexity | 190.0 |
Chemical Identifiers
| CAS Number | 5443-89-0 |
|---|---|
| SMILES | CCCCCSC1=NC=NC2=C1NC=N2 |
| InChIKey | UDXMVJZRHSMPEJ-UHFFFAOYSA-N |
Product Overview
6-(Pentylthio)purine (CAS 5443-89-0), with molecular formula C10H14N4S and molecular weight 222.09 g/mol. IUPAC: 6-pentylsulfanyl-7H-purine.
Chemical Property Profile of 6-(Pentylthio)purine
Property Insights of 6-(Pentylthio)purine
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(Pentylthio)purine. The TPSA of 79.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-(Pentylthio)purine. Following Lipinski's Rule of Five, 6-(Pentylthio)purine has 1 hydrogen bond donor(s) and 4 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-(Pentylthio)purine?
The CAS number of 6-(Pentylthio)purine is 5443-89-0.
What is the molecular formula of 6-(Pentylthio)purine?
The molecular formula of 6-(Pentylthio)purine is C10H14N4S.
What is the molecular weight of 6-(Pentylthio)purine?
The molecular weight of 6-(Pentylthio)purine is 222.09 g/mol.
Where can I buy 6-(Pentylthio)purine?
You can request a quote for 6-(Pentylthio)purine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(Pentylthio)purine?
Yes, KEHONG BIO provides custom synthesis services for 6-(Pentylthio)purine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.