Clofarabine triphosphate
TL;DR: Clofarabine triphosphate (CAS 167620-89-5) is a chemical compound with molecular formula C10H14ClFN5O12P3 and molecular weight 542.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[(2R,3R,4S,5R)-5-(6-amino-2-chloropurin-9-yl)-4-fluoro-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Also Known As: CLOFARABINE TRIPHOSPHATE, Clofarabine-5'-triphosphate, Clofarabine Triphosphate Triethylamine Salt, [[(2R,3R,4S,5R)-5-(6-amino-2-chloropurin-9-yl)-4-fluoro-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate, N0001-006173
| Molecular Formula | C10H14ClFN5O12P3 |
|---|---|
| Molecular Weight | 542.95 g/mol |
| LogP | 0.0016 |
| Topological Polar Surface Area | 258.9 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 8 |
| Exact Mass | 542.95245 |
| Heavy Atoms | 32 |
| Complexity | 1161.8986 |
Chemical Identifiers
| CAS Number | 167620-89-5 |
|---|---|
| SMILES | C1=NC2=C(N=C(N=C2N1[C@H]3[C@H]([C@@H]([C@H](O3)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)F)Cl)N |
Product Overview
Clofarabine triphosphate (CAS 167620-89-5), with molecular formula C10H14ClFN5O12P3 and molecular weight 542.95 g/mol. IUPAC: [[(2R,3R,4S,5R)-5-(6-amino-2-chloropurin-9-yl)-4-fluoro-3-hydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate.
Chemical Property Profile of Clofarabine triphosphate
Property Insights of Clofarabine triphosphate
The XLogP value of 0.0016 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Clofarabine triphosphate. The TPSA of 258.9 Ų indicates high polarity, suggesting Clofarabine triphosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Clofarabine triphosphate has 6 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Clofarabine triphosphate?
The CAS number of Clofarabine triphosphate is 167620-89-5.
What is the molecular formula of Clofarabine triphosphate?
The molecular formula of Clofarabine triphosphate is C10H14ClFN5O12P3.
What is the molecular weight of Clofarabine triphosphate?
The molecular weight of Clofarabine triphosphate is 542.95 g/mol.
Where can I buy Clofarabine triphosphate?
You can request a quote for Clofarabine triphosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Clofarabine triphosphate?
Yes, KEHONG BIO provides custom synthesis services for Clofarabine triphosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.