4-(9H-Purin-6-ylthio)butanoic acid
TL;DR: 4-(9H-Purin-6-ylthio)butanoic acid (CAS 608-11-7) is a chemical compound with molecular formula C9H10N4O2S and molecular weight 238.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(7H-purin-6-ylsulfanyl)butanoic acid
Also Known As: 4-(9H-Purin-6-ylthio)butanoic acid, 4-(7H-purin-6-ylsulfanyl)butanoic Acid, 4-[(7H-Purin-6-yl)sulfanyl]butanoic acid
| Molecular Formula | C9H10N4O2S |
|---|---|
| Molecular Weight | 238.05 g/mol |
| LogP | 1.3098 |
| Topological Polar Surface Area | 91.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 238.05244 |
| Heavy Atoms | 16 |
| Complexity | 498.96957 |
Chemical Identifiers
| CAS Number | 608-11-7 |
|---|---|
| SMILES | C1=NC2=C(N1)C(=NC=N2)SCCCC(=O)O |
Product Overview
4-(9H-Purin-6-ylthio)butanoic acid (CAS 608-11-7), with molecular formula C9H10N4O2S and molecular weight 238.05 g/mol. IUPAC: 4-(7H-purin-6-ylsulfanyl)butanoic acid.
Chemical Property Profile of 4-(9H-Purin-6-ylthio)butanoic acid
Property Insights of 4-(9H-Purin-6-ylthio)butanoic acid
The XLogP value of 1.3098 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(9H-Purin-6-ylthio)butanoic acid. The TPSA of 91.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(9H-Purin-6-ylthio)butanoic acid. Following Lipinski's Rule of Five, 4-(9H-Purin-6-ylthio)butanoic acid has 2 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 4-(9H-Purin-6-ylthio)butanoic acid?
The CAS number of 4-(9H-Purin-6-ylthio)butanoic acid is 608-11-7.
What is the molecular formula of 4-(9H-Purin-6-ylthio)butanoic acid?
The molecular formula of 4-(9H-Purin-6-ylthio)butanoic acid is C9H10N4O2S.
What is the molecular weight of 4-(9H-Purin-6-ylthio)butanoic acid?
The molecular weight of 4-(9H-Purin-6-ylthio)butanoic acid is 238.05 g/mol.
Where can I buy 4-(9H-Purin-6-ylthio)butanoic acid?
You can request a quote for 4-(9H-Purin-6-ylthio)butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(9H-Purin-6-ylthio)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-(9H-Purin-6-ylthio)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.