8-Bromoadenosine 5'-triphosphate
TL;DR: 8-Bromoadenosine 5'-triphosphate (CAS 23567-97-7) is a chemical compound with molecular formula C10H15BrN5O13P3 and molecular weight 584.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[(2R,3S,4R,5R)-5-(2-amino-8-bromopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Also Known As: 8-Bromo-ATP, 8-Bromoadenosine 5'-triphosphate, Adenosine 5'-(tetrahydrogen triphosphate), 8-bromo-, [[(2R,3S,4R,5R)-5-(2-amino-8-bromopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate, 8-Bromo-9-[5-O-(hydroxy{[hydroxy(phosphonooxy)phosphoryl]oxy}phosphoryl)-beta-D-ribofuranosyl]-9H-purin-2-amine
| Molecular Formula | C10H15BrN5O13P3 |
|---|---|
| Molecular Weight | 584.91 g/mol |
| LogP | -0.8665 |
| Topological Polar Surface Area | 279.13 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 8 |
| Exact Mass | 584.90625 |
| Heavy Atoms | 32 |
| Complexity | 1156.8125 |
Chemical Identifiers
| CAS Number | 23567-97-7 |
|---|---|
| SMILES | C1=C2C(=NC(=N1)N)N(C(=N2)Br)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O |
Product Overview
8-Bromoadenosine 5'-triphosphate (CAS 23567-97-7), with molecular formula C10H15BrN5O13P3 and molecular weight 584.91 g/mol. IUPAC: [[(2R,3S,4R,5R)-5-(2-amino-8-bromopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate.
Chemical Property Profile of 8-Bromoadenosine 5'-triphosphate
Property Insights of 8-Bromoadenosine 5'-triphosphate
The XLogP value of -0.8665 indicates that 8-Bromoadenosine 5'-triphosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 279.13 Ų indicates high polarity, suggesting 8-Bromoadenosine 5'-triphosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 8-Bromoadenosine 5'-triphosphate has 7 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 8-Bromoadenosine 5'-triphosphate?
The CAS number of 8-Bromoadenosine 5'-triphosphate is 23567-97-7.
What is the molecular formula of 8-Bromoadenosine 5'-triphosphate?
The molecular formula of 8-Bromoadenosine 5'-triphosphate is C10H15BrN5O13P3.
What is the molecular weight of 8-Bromoadenosine 5'-triphosphate?
The molecular weight of 8-Bromoadenosine 5'-triphosphate is 584.91 g/mol.
Where can I buy 8-Bromoadenosine 5'-triphosphate?
You can request a quote for 8-Bromoadenosine 5'-triphosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-Bromoadenosine 5'-triphosphate?
Yes, KEHONG BIO provides custom synthesis services for 8-Bromoadenosine 5'-triphosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.