2'-Fluoro-2'-deoxyadenosine triphosphate
TL;DR: 2'-Fluoro-2'-deoxyadenosine triphosphate (CAS 76403-90-2) is a chemical compound with molecular formula C10H15FN5O12P3 and molecular weight 508.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-4-fluoro-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Also Known As: 2-Fluoro-datp, 2-Dfladtp, 2'-FdATP, 2'-Deoxy-2'-fluoroadenosine triphosphate, 2'-Fluoro-2'-deoxyadenosine triphosphate
| Molecular Formula | C10H15FN5O12P3 |
|---|---|
| Molecular Weight | 508.99 g/mol |
| LogP | -4.7 |
| Topological Polar Surface Area | 259.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 8 |
| Exact Mass | 508.99142 |
| Heavy Atoms | 31 |
| Complexity | 805.0 |
Chemical Identifiers
| CAS Number | 76403-90-2 |
|---|---|
| SMILES | C1=NC(=C2C(=N1)N(C=N2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)F)N |
| InChIKey | CCXCDDWASROAJA-QYYRPYCUSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2'-Fluoro-2'-deoxyadenosine triphosphate (CAS 76403-90-2), with molecular formula C10H15FN5O12P3 and molecular weight 508.99 g/mol. IUPAC: [[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-4-fluoro-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate.
Chemical Property Profile of 2'-Fluoro-2'-deoxyadenosine triphosphate
Property Insights of 2'-Fluoro-2'-deoxyadenosine triphosphate
The XLogP value of -4.7 indicates that 2'-Fluoro-2'-deoxyadenosine 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 2'-Fluoro-2'-deoxyadenosine triphosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2'-Fluoro-2'-deoxyadenosine triphosphate has 6 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2'-Fluoro-2'-deoxyadenosine triphosphate?
The CAS number of 2'-Fluoro-2'-deoxyadenosine triphosphate is 76403-90-2.
What is the molecular formula of 2'-Fluoro-2'-deoxyadenosine triphosphate?
The molecular formula of 2'-Fluoro-2'-deoxyadenosine triphosphate is C10H15FN5O12P3.
What is the molecular weight of 2'-Fluoro-2'-deoxyadenosine triphosphate?
The molecular weight of 2'-Fluoro-2'-deoxyadenosine triphosphate is 508.99 g/mol.
Where can I buy 2'-Fluoro-2'-deoxyadenosine triphosphate?
You can request a quote for 2'-Fluoro-2'-deoxyadenosine triphosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2'-Fluoro-2'-deoxyadenosine triphosphate?
Yes, KEHONG BIO provides custom synthesis services for 2'-Fluoro-2'-deoxyadenosine triphosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.