(RS)-9-(2,3-Dihydroxypropyl)-8-mercaptoadenine
TL;DR: (RS)-9-(2,3-Dihydroxypropyl)-8-mercaptoadenine (CAS 69400-33-5) is a chemical compound with molecular formula C8H11N5O2S and molecular weight 241.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-9-(2,3-dihydroxypropyl)-7H-purine-8-thione
Also Known As: (RS)-9-(2,3-Dihydroxypropyl)-8-mercaptoadenine, 3-(6-amino-8-sulfanylpurin-9-yl)propane-1,2-diol, 3-(6-amino-8-sulfanyl-purin-9-yl)propane-1,2-diol, 6-amino-9-(2,3-dihydroxypropyl)-7H-purine-8-thione, 3-(6-AMINO-8-MERCAPTO-PURIN-9-YL)-PROPANE-1,2-DIOL
| Molecular Formula | C8H11N5O2S |
|---|---|
| Molecular Weight | 241.06 g/mol |
| LogP | -0.57571 |
| Topological Polar Surface Area | 112.98 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 241.06334 |
| Heavy Atoms | 16 |
| Complexity | 563.04425 |
Chemical Identifiers
| CAS Number | 69400-33-5 |
|---|---|
| SMILES | C1=NC(=C2C(=N1)N(C(=S)N2)CC(CO)O)N |
Product Overview
(RS)-9-(2,3-Dihydroxypropyl)-8-mercaptoadenine (CAS 69400-33-5), with molecular formula C8H11N5O2S and molecular weight 241.06 g/mol. IUPAC: 6-amino-9-(2,3-dihydroxypropyl)-7H-purine-8-thione.
Chemical Property Profile of (RS)-9-(2,3-Dihydroxypropyl)-8-mercaptoadenine
Property Insights of (RS)-9-(2,3-Dihydroxypropyl)-8-mercaptoadenine
The XLogP value of -0.57571 indicates that (RS)-9-(2,3-Dihydroxypropyl)-8-mercaptoadenine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 112.98 Ų falls within the moderate polarity range, balancing permeability and solubility for (RS)-9-(2,3-Dihydroxypropyl)-8-mercaptoadenine. Following Lipinski's Rule of Five, (RS)-9-(2,3-Dihydroxypropyl)-8-mercaptoadenine has 4 hydrogen bond donor(s) and 6 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 (RS)-9-(2,3-Dihydroxypropyl)-8-mercaptoadenine?
The CAS number of (RS)-9-(2,3-Dihydroxypropyl)-8-mercaptoadenine is 69400-33-5.
What is the molecular formula of (RS)-9-(2,3-Dihydroxypropyl)-8-mercaptoadenine?
The molecular formula of (RS)-9-(2,3-Dihydroxypropyl)-8-mercaptoadenine is C8H11N5O2S.
What is the molecular weight of (RS)-9-(2,3-Dihydroxypropyl)-8-mercaptoadenine?
The molecular weight of (RS)-9-(2,3-Dihydroxypropyl)-8-mercaptoadenine is 241.06 g/mol.
Where can I buy (RS)-9-(2,3-Dihydroxypropyl)-8-mercaptoadenine?
You can request a quote for (RS)-9-(2,3-Dihydroxypropyl)-8-mercaptoadenine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (RS)-9-(2,3-Dihydroxypropyl)-8-mercaptoadenine?
Yes, KEHONG BIO provides custom synthesis services for (RS)-9-(2,3-Dihydroxypropyl)-8-mercaptoadenine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.