5-Bromouridine triphosphate
TL;DR: 5-Bromouridine triphosphate (CAS 3398-50-3) is a chemical compound with molecular formula C9H14BrN2O15P3 and molecular weight 561.88 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[(2R,3S,4R)-5-(5-bromo-2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Also Known As: 5-Br-Utp, 5-Bromo-utp, 5-bromouridine triphosphate, 5-bromouridine-5'-triphosphate, 5-bromouridine 5'-(tetrahydrogen triphosphate)
| Molecular Formula | C9H14BrN2O15P3 |
|---|---|
| Molecular Weight | 561.88 g/mol |
| LogP | -5.2 |
| Topological Polar Surface Area | 259.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 15 |
| Rotatable Bonds | 8 |
| Exact Mass | 561.879 |
| Heavy Atoms | 30 |
| Complexity | 889.0 |
Chemical Identifiers
| CAS Number | 3398-50-3 |
|---|---|
| SMILES | C1=C(C(=O)NC(=O)N1C2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O)Br |
| InChIKey | IWFHOSULCAJGRM-CDRSNLLMSA-N |
Product Overview
5-Bromouridine triphosphate (CAS 3398-50-3), with molecular formula C9H14BrN2O15P3 and molecular weight 561.88 g/mol. IUPAC: [[(2R,3S,4R)-5-(5-bromo-2,4-dioxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate.
Chemical Property Profile of 5-Bromouridine triphosphate
Property Insights of 5-Bromouridine triphosphate
The XLogP value of -5.2 indicates that 5-Bromouridine triphosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 259.0 Ų indicates high polarity, suggesting 5-Bromouridine triphosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5-Bromouridine triphosphate has 7 hydrogen bond donor(s) and 15 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-Bromouridine triphosphate?
The CAS number of 5-Bromouridine triphosphate is 3398-50-3.
What is the molecular formula of 5-Bromouridine triphosphate?
The molecular formula of 5-Bromouridine triphosphate is C9H14BrN2O15P3.
What is the molecular weight of 5-Bromouridine triphosphate?
The molecular weight of 5-Bromouridine triphosphate is 561.88 g/mol.
Where can I buy 5-Bromouridine triphosphate?
You can request a quote for 5-Bromouridine triphosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Bromouridine triphosphate?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromouridine triphosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.