9-[2-o-(Methylsulfonyl)-4-thiopentofuranosyl]-9h-purin-6-amine
TL;DR: 9-[2-o-(Methylsulfonyl)-4-thiopentofuranosyl]-9h-purin-6-amine (CAS 15079-20-6) is a chemical compound with molecular formula C11H15N5O5S2 and molecular weight 361.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(6-aminopurin-9-yl)-4-hydroxy-5-(hydroxymethyl)thiolan-3-yl] methanesulfonate
Also Known As: 9-[2-o-(methylsulfonyl)-4-thiopentofuranosyl]-9h-purin-6-amine, 9-[2-O-(Methanesulfonyl)-4-thiopentofuranosyl]-9H-purin-6-amine, [2-(6-aminopurin-9-yl)-4-hydroxy-5-(hydroxymethyl)thiolan-3-yl] methanesulfonate
| Molecular Formula | C11H15N5O5S2 |
|---|---|
| Molecular Weight | 361.05 g/mol |
| LogP | -1.0 |
| Topological Polar Surface Area | 187.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 4 |
| Exact Mass | 361.05145 |
| Heavy Atoms | 23 |
| Complexity | 531.0 |
Chemical Identifiers
| CAS Number | 15079-20-6 |
|---|---|
| SMILES | CS(=O)(=O)OC1C(C(SC1N2C=NC3=C(N=CN=C32)N)CO)O |
| InChIKey | BIUDFZVWSMHLPD-UHFFFAOYSA-N |
Product Overview
9-[2-o-(Methylsulfonyl)-4-thiopentofuranosyl]-9h-purin-6-amine (CAS 15079-20-6), with molecular formula C11H15N5O5S2 and molecular weight 361.05 g/mol. IUPAC: [2-(6-aminopurin-9-yl)-4-hydroxy-5-(hydroxymethyl)thiolan-3-yl] methanesulfonate.
Chemical Property Profile of 9-[2-o-(Methylsulfonyl)-4-thiopentofuranosyl]-9h-purin-6-amine
Property Insights of 9-[2-o-(Methylsulfonyl)-4-thiopentofuranosyl]-9h-purin-6-amine
The XLogP value of -1.0 indicates that 9-[2-o-(Methylsulfonyl)-4-thiopentofuranosyl]-9h-purin-6-amine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 187.0 Ų indicates high polarity, suggesting 9-[2-o-(Methylsulfonyl)-4-thiopentofuranosyl]-9h-purin-6-amine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 9-[2-o-(Methylsulfonyl)-4-thiopentofuranosyl]-9h-purin-6-amine has 3 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 9-[2-o-(Methylsulfonyl)-4-thiopentofuranosyl]-9h-purin-6-amine?
The CAS number of 9-[2-o-(Methylsulfonyl)-4-thiopentofuranosyl]-9h-purin-6-amine is 15079-20-6.
What is the molecular formula of 9-[2-o-(Methylsulfonyl)-4-thiopentofuranosyl]-9h-purin-6-amine?
The molecular formula of 9-[2-o-(Methylsulfonyl)-4-thiopentofuranosyl]-9h-purin-6-amine is C11H15N5O5S2.
What is the molecular weight of 9-[2-o-(Methylsulfonyl)-4-thiopentofuranosyl]-9h-purin-6-amine?
The molecular weight of 9-[2-o-(Methylsulfonyl)-4-thiopentofuranosyl]-9h-purin-6-amine is 361.05 g/mol.
Where can I buy 9-[2-o-(Methylsulfonyl)-4-thiopentofuranosyl]-9h-purin-6-amine?
You can request a quote for 9-[2-o-(Methylsulfonyl)-4-thiopentofuranosyl]-9h-purin-6-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-[2-o-(Methylsulfonyl)-4-thiopentofuranosyl]-9h-purin-6-amine?
Yes, KEHONG BIO provides custom synthesis services for 9-[2-o-(Methylsulfonyl)-4-thiopentofuranosyl]-9h-purin-6-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.