6-Thioguanosine hydrate
TL;DR: 6-Thioguanosine hydrate (CAS 85-31-4) is a chemical compound with molecular formula C10H15N5O5S and molecular weight 317.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purine-6-thione;hydrate
Also Known As: 6-Thioguanosine hydrate, THIOGUANOSINE, THIOGUANOSINE HYDRATE, 6-thioguanosine monohydrate, Thioguanosine; NSC-29422;
| Molecular Formula | C10H15N5O5S |
|---|---|
| Molecular Weight | 317.08 g/mol |
| LogP | -2.14211 |
| Topological Polar Surface Area | 173.94 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 317.07938 |
| Heavy Atoms | 21 |
| Complexity | 702.6935 |
Chemical Identifiers
| CAS Number | 85-31-4 |
|---|---|
| SMILES | C1=NC2=C(N1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)NC(=NC2=S)N.O |
Product Overview
6-Thioguanosine hydrate (CAS 85-31-4), with molecular formula C10H15N5O5S and molecular weight 317.08 g/mol. IUPAC: 2-amino-9-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-3H-purine-6-thione;hydrate.
Chemical Property Profile of 6-Thioguanosine hydrate
Property Insights of 6-Thioguanosine hydrate
The XLogP value of -2.14211 indicates that 6-Thioguanosine hydrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 173.94 Ų indicates high polarity, suggesting 6-Thioguanosine hydrate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 6-Thioguanosine hydrate has 5 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 6-Thioguanosine hydrate?
The CAS number of 6-Thioguanosine hydrate is 85-31-4.
What is the molecular formula of 6-Thioguanosine hydrate?
The molecular formula of 6-Thioguanosine hydrate is C10H15N5O5S.
What is the molecular weight of 6-Thioguanosine hydrate?
The molecular weight of 6-Thioguanosine hydrate is 317.08 g/mol.
Where can I buy 6-Thioguanosine hydrate?
You can request a quote for 6-Thioguanosine hydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Thioguanosine hydrate?
Yes, KEHONG BIO provides custom synthesis services for 6-Thioguanosine hydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.