![2-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-5-(hydroxymethyl)-4-nitrooxolan-3-ol structure](/static/products/5526/55263-65-5.webp)
2-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-5-(hydroxymethyl)-4-nitrooxolan-3-ol
TL;DR: 2-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-5-(hydroxymethyl)-4-nitrooxolan-3-ol (CAS 55263-65-5) is a chemical compound with molecular formula C13H18N6O5S and molecular weight 370.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-5-(hydroxymethyl)-4-nitrooxolan-3-ol
Also Known As: 2-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-5-(hydroxymethyl)-4-nitrooxolan-3-ol, 9-(3-deoxy-3-nitropentofuranosyl)-N,N-dimethyl-2-(methylsulfanyl)-9H-purin-6-amine
| Molecular Formula | C13H18N6O5S |
|---|---|
| Molecular Weight | 370.11 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 168.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 370.10593 |
| Heavy Atoms | 25 |
| Complexity | 496.0 |
Chemical Identifiers
| CAS Number | 55263-65-5 |
|---|---|
| SMILES | CN(C)C1=NC(=NC2=C1N=CN2C3C(C(C(O3)CO)[N+](=O)[O-])O)SC |
| InChIKey | QRSQIPLSMQHUDZ-UHFFFAOYSA-N |
Product Overview
2-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-5-(hydroxymethyl)-4-nitrooxolan-3-ol (CAS 55263-65-5), with molecular formula C13H18N6O5S and molecular weight 370.11 g/mol. IUPAC: 2-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-5-(hydroxymethyl)-4-nitrooxolan-3-ol.
Chemical Property Profile of 2-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-5-(hydroxymethyl)-4-nitrooxolan-3-ol
Property Insights of 2-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-5-(hydroxymethyl)-4-nitrooxolan-3-ol
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-5-(hydroxymethyl)-4-nitrooxolan-3-ol. The TPSA of 168.0 Ų indicates high polarity, suggesting 2-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-5-(hydroxymethyl)-4-nitrooxolan-3-ol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-5-(hydroxymethyl)-4-nitrooxolan-3-ol has 2 hydrogen bond donor(s) and 10 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 2-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-5-(hydroxymethyl)-4-nitrooxolan-3-ol?
The CAS number of 2-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-5-(hydroxymethyl)-4-nitrooxolan-3-ol is 55263-65-5.
What is the molecular formula of 2-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-5-(hydroxymethyl)-4-nitrooxolan-3-ol?
The molecular formula of 2-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-5-(hydroxymethyl)-4-nitrooxolan-3-ol is C13H18N6O5S.
What is the molecular weight of 2-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-5-(hydroxymethyl)-4-nitrooxolan-3-ol?
The molecular weight of 2-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-5-(hydroxymethyl)-4-nitrooxolan-3-ol is 370.11 g/mol.
Where can I buy 2-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-5-(hydroxymethyl)-4-nitrooxolan-3-ol?
You can request a quote for 2-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-5-(hydroxymethyl)-4-nitrooxolan-3-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-5-(hydroxymethyl)-4-nitrooxolan-3-ol?
Yes, KEHONG BIO provides custom synthesis services for 2-[6-(dimethylamino)-2-methylsulfanylpurin-9-yl]-5-(hydroxymethyl)-4-nitrooxolan-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.