9-[3,4-dihydroxy-5-(hydroxymethyl)thiolan-2-yl]-3H-purine-6-thione
TL;DR: 9-[3,4-dihydroxy-5-(hydroxymethyl)thiolan-2-yl]-3H-purine-6-thione (CAS 25795-67-9) is a chemical compound with molecular formula C10H12N4O3S2 and molecular weight 300.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-[3,4-dihydroxy-5-(hydroxymethyl)thiolan-2-yl]-3H-purine-6-thione
Also Known As: Inosine, 4',6-dithio-(9CI), 9-(4-Thiopentofuranosyl)-3,9-dihydro-6H-purine-6-thione, 9-[3,4-dihydroxy-5-(hydroxymethyl)thiolan-2-yl]-3H-purine-6-thione
| Molecular Formula | C10H12N4O3S2 |
|---|---|
| Molecular Weight | 300.04 g/mol |
| LogP | -0.18301 |
| Topological Polar Surface Area | 107.19 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 300.0351 |
| Heavy Atoms | 19 |
| Complexity | 657.5073 |
Chemical Identifiers
| CAS Number | 25795-67-9 |
|---|---|
| SMILES | C1=NC(=S)C2=C(N1)N(C=N2)C3C(C(C(S3)CO)O)O |
Product Overview
9-[3,4-dihydroxy-5-(hydroxymethyl)thiolan-2-yl]-3H-purine-6-thione (CAS 25795-67-9), with molecular formula C10H12N4O3S2 and molecular weight 300.04 g/mol. IUPAC: 9-[3,4-dihydroxy-5-(hydroxymethyl)thiolan-2-yl]-3H-purine-6-thione.
Chemical Property Profile of 9-[3,4-dihydroxy-5-(hydroxymethyl)thiolan-2-yl]-3H-purine-6-thione
Property Insights of 9-[3,4-dihydroxy-5-(hydroxymethyl)thiolan-2-yl]-3H-purine-6-thione
The XLogP value of -0.18301 indicates that 9-[3,4-dihydroxy-5-(hydroxymethyl)thiolan-2-yl]-3H-purine-6-thione is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 107.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-[3,4-dihydroxy-5-(hydroxymethyl)thiolan-2-yl]-3H-purine-6-thione. Following Lipinski's Rule of Five, 9-[3,4-dihydroxy-5-(hydroxymethyl)thiolan-2-yl]-3H-purine-6-thione has 4 hydrogen bond donor(s) and 7 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-[3,4-dihydroxy-5-(hydroxymethyl)thiolan-2-yl]-3H-purine-6-thione?
The CAS number of 9-[3,4-dihydroxy-5-(hydroxymethyl)thiolan-2-yl]-3H-purine-6-thione is 25795-67-9.
What is the molecular formula of 9-[3,4-dihydroxy-5-(hydroxymethyl)thiolan-2-yl]-3H-purine-6-thione?
The molecular formula of 9-[3,4-dihydroxy-5-(hydroxymethyl)thiolan-2-yl]-3H-purine-6-thione is C10H12N4O3S2.
What is the molecular weight of 9-[3,4-dihydroxy-5-(hydroxymethyl)thiolan-2-yl]-3H-purine-6-thione?
The molecular weight of 9-[3,4-dihydroxy-5-(hydroxymethyl)thiolan-2-yl]-3H-purine-6-thione is 300.04 g/mol.
Where can I buy 9-[3,4-dihydroxy-5-(hydroxymethyl)thiolan-2-yl]-3H-purine-6-thione?
You can request a quote for 9-[3,4-dihydroxy-5-(hydroxymethyl)thiolan-2-yl]-3H-purine-6-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-[3,4-dihydroxy-5-(hydroxymethyl)thiolan-2-yl]-3H-purine-6-thione?
Yes, KEHONG BIO provides custom synthesis services for 9-[3,4-dihydroxy-5-(hydroxymethyl)thiolan-2-yl]-3H-purine-6-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.