1beta-D-Arabinofuranosylcytosine diphosphate choline
TL;DR: 1beta-D-Arabinofuranosylcytosine diphosphate choline (CAS 68254-32-0) is a chemical compound with molecular formula C14H26N4O11P2 and molecular weight 488.11 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)-3,4-dihydroxyoxolan-2-yl]methyl [hydroxy-[2-(trimethylazaniumyl)ethoxy]phosphoryl] phosphate
Also Known As: Citicolinum, Cid 125658, 1beta-D-Arabinofuranosylcytosine diphosphate choline, [(2R,3S,4S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl [hydroxy-[2-(trimethylazaniumyl)ethoxy]phosphoryl] phosphate, 4-amino-1-{5-o-[({hydroxy[2-(trimethylammonio)ethoxy]phosphoryl}oxy)phosphinato]-
| Molecular Formula | C14H26N4O11P2 |
|---|---|
| Molecular Weight | 488.11 g/mol |
| LogP | -4.0 |
| Topological Polar Surface Area | 214.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 10 |
| Exact Mass | 488.10733 |
| Heavy Atoms | 31 |
| Complexity | 821.0 |
Chemical Identifiers
| CAS Number | 68254-32-0 |
|---|---|
| SMILES | C[N+](C)(C)CCOP(=O)(O)OP(=O)([O-])OC[C@@H]1[C@H]([C@@H]([C@@H](O1)N2C=CC(=NC2=O)N)O)O |
| InChIKey | RZZPDXZPRHQOCG-FOUMNBMASA-N |
Product Overview
1beta-D-Arabinofuranosylcytosine diphosphate choline (CAS 68254-32-0), with molecular formula C14H26N4O11P2 and molecular weight 488.11 g/mol. IUPAC: [(2R,3S,4S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl [hydroxy-[2-(trimethylazaniumyl)ethoxy]phosphoryl] phosphate.
Chemical Property Profile of 1beta-D-Arabinofuranosylcytosine diphosphate choline
Property Insights of 1beta-D-Arabinofuranosylcytosine diphosphate choline
The XLogP value of -4.0 indicates that 1beta-D-Arabinofuranosylcytosine diphosphate choline is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 214.0 Ų indicates high polarity, suggesting 1beta-D-Arabinofuranosylcytosine diphosphate choline may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1beta-D-Arabinofuranosylcytosine diphosphate choline has 4 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 1beta-D-Arabinofuranosylcytosine diphosphate choline?
The CAS number of 1beta-D-Arabinofuranosylcytosine diphosphate choline is 68254-32-0.
What is the molecular formula of 1beta-D-Arabinofuranosylcytosine diphosphate choline?
The molecular formula of 1beta-D-Arabinofuranosylcytosine diphosphate choline is C14H26N4O11P2.
What is the molecular weight of 1beta-D-Arabinofuranosylcytosine diphosphate choline?
The molecular weight of 1beta-D-Arabinofuranosylcytosine diphosphate choline is 488.11 g/mol.
Where can I buy 1beta-D-Arabinofuranosylcytosine diphosphate choline?
You can request a quote for 1beta-D-Arabinofuranosylcytosine diphosphate choline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1beta-D-Arabinofuranosylcytosine diphosphate choline?
Yes, KEHONG BIO provides custom synthesis services for 1beta-D-Arabinofuranosylcytosine diphosphate choline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.