9-Pentofuranosyl-6-(propylsulfanyl)-9h-purin-2-amine
TL;DR: 9-Pentofuranosyl-6-(propylsulfanyl)-9h-purin-2-amine (CAS 4889-43-4) is a chemical compound with molecular formula C13H19N5O4S and molecular weight 341.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-amino-6-propylsulfanylpurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
Also Known As: 9-pentofuranosyl-6-(propylsulfanyl)-9h-purin-2-amine, 2-(2-amino-6-propylsulfanylpurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
| Molecular Formula | C13H19N5O4S |
|---|---|
| Molecular Weight | 341.12 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 165.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 341.11578 |
| Heavy Atoms | 23 |
| Complexity | 409.0 |
Chemical Identifiers
| CAS Number | 4889-43-4 |
|---|---|
| SMILES | CCCSC1=NC(=NC2=C1N=CN2C3C(C(C(O3)CO)O)O)N |
| InChIKey | CBOHCFKUQKUAQU-UHFFFAOYSA-N |
Product Overview
9-Pentofuranosyl-6-(propylsulfanyl)-9h-purin-2-amine (CAS 4889-43-4), with molecular formula C13H19N5O4S and molecular weight 341.12 g/mol. IUPAC: 2-(2-amino-6-propylsulfanylpurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol.
Chemical Property Profile of 9-Pentofuranosyl-6-(propylsulfanyl)-9h-purin-2-amine
Property Insights of 9-Pentofuranosyl-6-(propylsulfanyl)-9h-purin-2-amine
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-Pentofuranosyl-6-(propylsulfanyl)-9h-purin-2-amine. The TPSA of 165.0 Ų indicates high polarity, suggesting 9-Pentofuranosyl-6-(propylsulfanyl)-9h-purin-2-amine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 9-Pentofuranosyl-6-(propylsulfanyl)-9h-purin-2-amine has 4 hydrogen bond donor(s) and 9 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-Pentofuranosyl-6-(propylsulfanyl)-9h-purin-2-amine?
The CAS number of 9-Pentofuranosyl-6-(propylsulfanyl)-9h-purin-2-amine is 4889-43-4.
What is the molecular formula of 9-Pentofuranosyl-6-(propylsulfanyl)-9h-purin-2-amine?
The molecular formula of 9-Pentofuranosyl-6-(propylsulfanyl)-9h-purin-2-amine is C13H19N5O4S.
What is the molecular weight of 9-Pentofuranosyl-6-(propylsulfanyl)-9h-purin-2-amine?
The molecular weight of 9-Pentofuranosyl-6-(propylsulfanyl)-9h-purin-2-amine is 341.12 g/mol.
Where can I buy 9-Pentofuranosyl-6-(propylsulfanyl)-9h-purin-2-amine?
You can request a quote for 9-Pentofuranosyl-6-(propylsulfanyl)-9h-purin-2-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-Pentofuranosyl-6-(propylsulfanyl)-9h-purin-2-amine?
Yes, KEHONG BIO provides custom synthesis services for 9-Pentofuranosyl-6-(propylsulfanyl)-9h-purin-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.