![4-{[6-(Methylsulfanyl)-9h-purin-9-yl]amino}butane-1,2,3-triol structure](/static/products/5792/5792-44-9.webp)
4-{[6-(Methylsulfanyl)-9h-purin-9-yl]amino}butane-1,2,3-triol
TL;DR: 4-{[6-(Methylsulfanyl)-9h-purin-9-yl]amino}butane-1,2,3-triol (CAS 5792-44-9) is a chemical compound with molecular formula C10H15N5O3S and molecular weight 285.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(6-methylsulfanylpurin-9-yl)amino]butane-1,2,3-triol
Also Known As: 4-{[6-(methylsulfanyl)-9h-purin-9-yl]amino}butane-1,2,3-triol, 4-[(6-methylsulfanylpurin-9-yl)amino]butane-1,2,3-triol, 4-((6-(Methylthio)-9H-purin-9-yl)amino)butane-1,2,3-triol, 6-(Methylthio)-9-<(2,3,4-trihydroxybutyl)amino>-9H-purin
| Molecular Formula | C10H15N5O3S |
|---|---|
| Molecular Weight | 285.09 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 142.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 285.08957 |
| Heavy Atoms | 19 |
| Complexity | 288.0 |
Chemical Identifiers
| CAS Number | 5792-44-9 |
|---|---|
| SMILES | CSC1=NC=NC2=C1N=CN2NCC(C(CO)O)O |
| InChIKey | PZGHZAMGYMTVEF-UHFFFAOYSA-N |
Product Overview
4-{[6-(Methylsulfanyl)-9h-purin-9-yl]amino}butane-1,2,3-triol (CAS 5792-44-9), with molecular formula C10H15N5O3S and molecular weight 285.09 g/mol. IUPAC: 4-[(6-methylsulfanylpurin-9-yl)amino]butane-1,2,3-triol.
Chemical Property Profile of 4-{[6-(Methylsulfanyl)-9h-purin-9-yl]amino}butane-1,2,3-triol
Property Insights of 4-{[6-(Methylsulfanyl)-9h-purin-9-yl]amino}butane-1,2,3-triol
The XLogP value of -0.1 indicates that 4-{[6-(Methylsulfanyl)-9h-purin-9-yl]amino}butane-1,2,3-triol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 142.0 Ų indicates high polarity, suggesting 4-{[6-(Methylsulfanyl)-9h-purin-9-yl]amino}butane-1,2,3-triol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-{[6-(Methylsulfanyl)-9h-purin-9-yl]amino}butane-1,2,3-triol has 4 hydrogen bond donor(s) and 8 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-{[6-(Methylsulfanyl)-9h-purin-9-yl]amino}butane-1,2,3-triol?
The CAS number of 4-{[6-(Methylsulfanyl)-9h-purin-9-yl]amino}butane-1,2,3-triol is 5792-44-9.
What is the molecular formula of 4-{[6-(Methylsulfanyl)-9h-purin-9-yl]amino}butane-1,2,3-triol?
The molecular formula of 4-{[6-(Methylsulfanyl)-9h-purin-9-yl]amino}butane-1,2,3-triol is C10H15N5O3S.
What is the molecular weight of 4-{[6-(Methylsulfanyl)-9h-purin-9-yl]amino}butane-1,2,3-triol?
The molecular weight of 4-{[6-(Methylsulfanyl)-9h-purin-9-yl]amino}butane-1,2,3-triol is 285.09 g/mol.
Where can I buy 4-{[6-(Methylsulfanyl)-9h-purin-9-yl]amino}butane-1,2,3-triol?
You can request a quote for 4-{[6-(Methylsulfanyl)-9h-purin-9-yl]amino}butane-1,2,3-triol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-{[6-(Methylsulfanyl)-9h-purin-9-yl]amino}butane-1,2,3-triol?
Yes, KEHONG BIO provides custom synthesis services for 4-{[6-(Methylsulfanyl)-9h-purin-9-yl]amino}butane-1,2,3-triol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.