3'-Fluoro-3'-deoxycytidine-5'-triphosphate
TL;DR: 3'-Fluoro-3'-deoxycytidine-5'-triphosphate (CAS 123402-25-5) is a chemical compound with molecular formula C9H15FN3O13P3 and molecular weight 484.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[(2R,3S,4S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Also Known As: 3'-Fluoro-3'-deoxycytidine-5'-triphosphate, cytidine, 5'-(tetrahydrogen triphosphate), 3'-deoxy-3'-fluoro-, [[(2R,3S,4S,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-3-fluoro-4-hydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl] phosphono hydrogen phosphate, [[(2R,3S,4S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
| Molecular Formula | C9H15FN3O13P3 |
|---|---|
| Molecular Weight | 484.98 g/mol |
| LogP | -4.6 |
| Topological Polar Surface Area | 248.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 8 |
| Exact Mass | 484.98016 |
| Heavy Atoms | 29 |
| Complexity | 860.0 |
Chemical Identifiers
| CAS Number | 123402-25-5 |
|---|---|
| SMILES | C1=CN(C(=O)N=C1N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)F)O |
| InChIKey | FJLMXGVLUAYZSC-XVFCMESISA-N |
Product Overview
3'-Fluoro-3'-deoxycytidine-5'-triphosphate (CAS 123402-25-5), with molecular formula C9H15FN3O13P3 and molecular weight 484.98 g/mol. IUPAC: [[(2R,3S,4S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3-fluoro-4-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate.
Chemical Property Profile of 3'-Fluoro-3'-deoxycytidine-5'-triphosphate
Property Insights of 3'-Fluoro-3'-deoxycytidine-5'-triphosphate
The XLogP value of -4.6 indicates that 3'-Fluoro-3'-deoxycytidine-5'-triphosphate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 248.0 Ų indicates high polarity, suggesting 3'-Fluoro-3'-deoxycytidine-5'-triphosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3'-Fluoro-3'-deoxycytidine-5'-triphosphate has 6 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3'-Fluoro-3'-deoxycytidine-5'-triphosphate?
The CAS number of 3'-Fluoro-3'-deoxycytidine-5'-triphosphate is 123402-25-5.
What is the molecular formula of 3'-Fluoro-3'-deoxycytidine-5'-triphosphate?
The molecular formula of 3'-Fluoro-3'-deoxycytidine-5'-triphosphate is C9H15FN3O13P3.
What is the molecular weight of 3'-Fluoro-3'-deoxycytidine-5'-triphosphate?
The molecular weight of 3'-Fluoro-3'-deoxycytidine-5'-triphosphate is 484.98 g/mol.
Where can I buy 3'-Fluoro-3'-deoxycytidine-5'-triphosphate?
You can request a quote for 3'-Fluoro-3'-deoxycytidine-5'-triphosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3'-Fluoro-3'-deoxycytidine-5'-triphosphate?
Yes, KEHONG BIO provides custom synthesis services for 3'-Fluoro-3'-deoxycytidine-5'-triphosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.