2-Fluoro-araatp
TL;DR: 2-Fluoro-araatp (CAS 78515-30-7) is a chemical compound with molecular formula C10H15FN5O13P3 and molecular weight 524.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[(2R,3S,4S)-5-(6-amino-2-fluoropurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Also Known As: 2-Fluoro-araatp, 2-F-Araatp, F-Ara-ATP, 2-Fluoro-adenosine triphosphate, 9beta-D-Arabinofuranosyl-2-fluoroadenine 5'-triphosphate
| Molecular Formula | C10H15FN5O13P3 |
|---|---|
| Molecular Weight | 524.99 g/mol |
| LogP | -5.3 |
| Topological Polar Surface Area | 279.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 18 |
| Rotatable Bonds | 8 |
| Exact Mass | 524.9863 |
| Heavy Atoms | 32 |
| Complexity | 836.0 |
Chemical Identifiers
| CAS Number | 78515-30-7 |
|---|---|
| SMILES | C1=NC2=C(N=C(N=C2N1C3[C@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)O)F)N |
| InChIKey | PIOKUWLZUXUBCO-PTSYZVBVSA-N |
Product Overview
2-Fluoro-araatp (CAS 78515-30-7), with molecular formula C10H15FN5O13P3 and molecular weight 524.99 g/mol. IUPAC: [[(2R,3S,4S)-5-(6-amino-2-fluoropurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate.
Chemical Property Profile of 2-Fluoro-araatp
Property Insights of 2-Fluoro-araatp
The XLogP value of -5.3 indicates that 2-Fluoro-araatp is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 279.0 Ų indicates high polarity, suggesting 2-Fluoro-araatp may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-Fluoro-araatp has 7 hydrogen bond donor(s) and 18 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-araatp?
The CAS number of 2-Fluoro-araatp is 78515-30-7.
What is the molecular formula of 2-Fluoro-araatp?
The molecular formula of 2-Fluoro-araatp is C10H15FN5O13P3.
What is the molecular weight of 2-Fluoro-araatp?
The molecular weight of 2-Fluoro-araatp is 524.99 g/mol.
Where can I buy 2-Fluoro-araatp?
You can request a quote for 2-Fluoro-araatp directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Fluoro-araatp?
Yes, KEHONG BIO provides custom synthesis services for 2-Fluoro-araatp and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.