8-Bromoadenosine 5'-diphosphate
TL;DR: 8-Bromoadenosine 5'-diphosphate (CAS 23600-16-0) is a chemical compound with molecular formula C10H14BrN5O10P2 and molecular weight 504.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(6-amino-8-bromopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphono hydrogen phosphate
Also Known As: 8-Bromoadenosine 5'-diphosphate, Adenosine 5'-(trihydrogen diphosphate), 8-bromo- (9CI), ((2R,3S,4R,5R)-5-(6-Amino-8-bromo-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)methyl trihydrogen diphosphate, [({[(2R,3S,4R,5R)-5-(6-amino-8-bromo-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy]phosphonic acid, [5-(6-amino-8-bromopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphono hydrogen phosphate
| Molecular Formula | C10H14BrN5O10P2 |
|---|---|
| Molecular Weight | 504.94 g/mol |
| LogP | -0.9835 |
| Topological Polar Surface Area | 232.6 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 6 |
| Exact Mass | 504.93994 |
| Heavy Atoms | 28 |
| Complexity | 982.9019 |
Chemical Identifiers
| CAS Number | 23600-16-0 |
|---|---|
| SMILES | C1=NC(=C2C(=N1)N(C(=N2)Br)C3C(C(C(O3)COP(=O)(O)OP(=O)(O)O)O)O)N |
Product Overview
8-Bromoadenosine 5'-diphosphate (CAS 23600-16-0), with molecular formula C10H14BrN5O10P2 and molecular weight 504.94 g/mol. IUPAC: [5-(6-amino-8-bromopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl phosphono hydrogen phosphate.
Chemical Property Profile of 8-Bromoadenosine 5'-diphosphate
Property Insights of 8-Bromoadenosine 5'-diphosphate
The XLogP value of -0.9835 indicates that 8-Bromoadenosine 5'-diphosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 232.6 Ų indicates high polarity, suggesting 8-Bromoadenosine 5'-diphosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 8-Bromoadenosine 5'-diphosphate has 6 hydrogen bond donor(s) and 11 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'-diphosphate?
The CAS number of 8-Bromoadenosine 5'-diphosphate is 23600-16-0.
What is the molecular formula of 8-Bromoadenosine 5'-diphosphate?
The molecular formula of 8-Bromoadenosine 5'-diphosphate is C10H14BrN5O10P2.
What is the molecular weight of 8-Bromoadenosine 5'-diphosphate?
The molecular weight of 8-Bromoadenosine 5'-diphosphate is 504.94 g/mol.
Where can I buy 8-Bromoadenosine 5'-diphosphate?
You can request a quote for 8-Bromoadenosine 5'-diphosphate 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'-diphosphate?
Yes, KEHONG BIO provides custom synthesis services for 8-Bromoadenosine 5'-diphosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.