Thiopurinol ribonucleoside monophosphate
TL;DR: Thiopurinol ribonucleoside monophosphate (CAS 81944-82-3) is a chemical compound with molecular formula C10H13N4O7PS and molecular weight 364.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S,4R,5S)-3,4-dihydroxy-5-(6-sulfanylidene-7H-purin-3-yl)oxolan-2-yl]methyl dihydrogen phosphate
Also Known As: Tppr-MP, Thiopurinol ribonucleoside monophosphate, [(2R,3S,4R,5S)-3,4-dihydroxy-5-(6-sulfanylidene-7H-purin-3-yl)oxolan-2-yl]methyl dihydrogen phosphate, 1,5-Dihydro-1-(5-O-phosphono-beta-D-ribofuranosyl)-4H-pyrazolo(3,2-d)pyrimidine-4-thione, 3-(5-O-Phosphono-alpha-D-ribofuranosyl)-3,7-dihydro-6H-purine-6-thione
| Molecular Formula | C10H13N4O7PS |
|---|---|
| Molecular Weight | 364.02 g/mol |
| LogP | -0.78261 |
| Topological Polar Surface Area | 162.95 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 364.02426 |
| Heavy Atoms | 23 |
| Complexity | 818.8875 |
Chemical Identifiers
| CAS Number | 81944-82-3 |
|---|---|
| SMILES | C1=NC2=C(N1)C(=S)N=CN2[C@@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O |
Product Overview
Thiopurinol ribonucleoside monophosphate (CAS 81944-82-3), with molecular formula C10H13N4O7PS and molecular weight 364.02 g/mol. IUPAC: [(2R,3S,4R,5S)-3,4-dihydroxy-5-(6-sulfanylidene-7H-purin-3-yl)oxolan-2-yl]methyl dihydrogen phosphate.
Chemical Property Profile of Thiopurinol ribonucleoside monophosphate
Property Insights of Thiopurinol ribonucleoside monophosphate
The XLogP value of -0.78261 indicates that Thiopurinol ribonucleoside monophosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 162.95 Ų indicates high polarity, suggesting Thiopurinol ribonucleoside monophosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Thiopurinol ribonucleoside monophosphate 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 Thiopurinol ribonucleoside monophosphate?
The CAS number of Thiopurinol ribonucleoside monophosphate is 81944-82-3.
What is the molecular formula of Thiopurinol ribonucleoside monophosphate?
The molecular formula of Thiopurinol ribonucleoside monophosphate is C10H13N4O7PS.
What is the molecular weight of Thiopurinol ribonucleoside monophosphate?
The molecular weight of Thiopurinol ribonucleoside monophosphate is 364.02 g/mol.
Where can I buy Thiopurinol ribonucleoside monophosphate?
You can request a quote for Thiopurinol ribonucleoside monophosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiopurinol ribonucleoside monophosphate?
Yes, KEHONG BIO provides custom synthesis services for Thiopurinol ribonucleoside monophosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.