5-Mercaptouridylic acid
TL;DR: 5-Mercaptouridylic acid (CAS 58380-75-9) is a chemical compound with molecular formula C9H13N2O9PS and molecular weight 356.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S,4R,5R)-5-(2,4-dioxo-5-sulfanylpyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate
Also Known As: 5-Mercaptouridylic acid, 5-Mercaptouridine monophosphate, 5-mercaptouridylicacid, 5'-Uridylic acid, 5-mercapto-, 5'-Uridylic acid,5-mercapto
| Molecular Formula | C9H13N2O9PS |
|---|---|
| Molecular Weight | 356.01 g/mol |
| LogP | -2.4462 |
| Topological Polar Surface Area | 171.31 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 356.00793 |
| Heavy Atoms | 22 |
| Complexity | 711.7741 |
Chemical Identifiers
| CAS Number | 58380-75-9 |
|---|---|
| SMILES | C1=C(C(=O)NC(=O)N1[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)O)O)O)S |
Product Overview
5-Mercaptouridylic acid (CAS 58380-75-9), with molecular formula C9H13N2O9PS and molecular weight 356.01 g/mol. IUPAC: [(2R,3S,4R,5R)-5-(2,4-dioxo-5-sulfanylpyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl dihydrogen phosphate.
Chemical Property Profile of 5-Mercaptouridylic acid
Property Insights of 5-Mercaptouridylic acid
The XLogP value of -2.4462 indicates that 5-Mercaptouridylic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 171.31 Ų indicates high polarity, suggesting 5-Mercaptouridylic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-Mercaptouridylic acid has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Mercaptouridylic acid?
The CAS number of 5-Mercaptouridylic acid is 58380-75-9.
What is the molecular formula of 5-Mercaptouridylic acid?
The molecular formula of 5-Mercaptouridylic acid is C9H13N2O9PS.
What is the molecular weight of 5-Mercaptouridylic acid?
The molecular weight of 5-Mercaptouridylic acid is 356.01 g/mol.
Where can I buy 5-Mercaptouridylic acid?
You can request a quote for 5-Mercaptouridylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Mercaptouridylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-Mercaptouridylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.