P(1)-(1-hexadecyl)-P(2)-(1-beta-arabinofuranosylcytosin-5'-yl)pyrophosphate
TL;DR: P(1)-(1-hexadecyl)-P(2)-(1-beta-arabinofuranosylcytosin-5'-yl)pyrophosphate (CAS 93605-01-7) is a chemical compound with molecular formula C25H47N3O11P2 and molecular weight 627.27 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]methoxy-hydroxyphosphoryl] hexadecyl hydrogen phosphate
Also Known As: Ara-cdp hexadecyl ester, [[(2R,3S,4S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] hexadecyl hydrogen phosphate, P(1)-(1-Hexadecyl)-P(2)-(1-beta-arabinofuranosylcytosin-5'-yl)pyrophosphate, [({[(2R,3S,4S,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hexadecyloxy)phosphinic acid, 1-{5-O-[{[(Hexadecyloxy)(hydroxy)phosphoryl]oxy}(hydroxy)phosphoryl]-beta-D-arabinofuranosyl}-4-imino-1,4-dihydropyrimidin-2-ol
| Molecular Formula | C25H47N3O11P2 |
|---|---|
| Molecular Weight | 627.27 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 211.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 22 |
| Exact Mass | 627.26855 |
| Heavy Atoms | 41 |
| Complexity | 952.0 |
Chemical Identifiers
| CAS Number | 93605-01-7 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCOP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@@H]([C@@H](O1)N2C=CC(=NC2=O)N)O)O |
| InChIKey | WFBXNSKPUCPBRG-CAUSLRQDSA-N |
Product Overview
P(1)-(1-hexadecyl)-P(2)-(1-beta-arabinofuranosylcytosin-5'-yl)pyrophosphate (CAS 93605-01-7), with molecular formula C25H47N3O11P2 and molecular weight 627.27 g/mol. IUPAC: [[(2R,3S,4S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl] hexadecyl hydrogen phosphate.
Chemical Property Profile of P(1)-(1-hexadecyl)-P(2)-(1-beta-arabinofuranosylcytosin-5'-yl)pyrophosphate
Property Insights of P(1)-(1-hexadecyl)-P(2)-(1-beta-arabinofuranosylcytosin-5'-yl)pyrophosphate
The XLogP value of 3.8 indicates that P(1)-(1-hexadecyl)-P(2)-(1-beta-arabinofuranosylcytosin-5'-yl)pyrophosphate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 211.0 Ų indicates high polarity, suggesting P(1)-(1-hexadecyl)-P(2)-(1-beta-arabinofuranosylcytosin-5'-yl)pyrophosphate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, P(1)-(1-hexadecyl)-P(2)-(1-beta-arabinofuranosylcytosin-5'-yl)pyrophosphate has 5 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 P(1)-(1-hexadecyl)-P(2)-(1-beta-arabinofuranosylcytosin-5'-yl)pyrophosphate?
The CAS number of P(1)-(1-hexadecyl)-P(2)-(1-beta-arabinofuranosylcytosin-5'-yl)pyrophosphate is 93605-01-7.
What is the molecular formula of P(1)-(1-hexadecyl)-P(2)-(1-beta-arabinofuranosylcytosin-5'-yl)pyrophosphate?
The molecular formula of P(1)-(1-hexadecyl)-P(2)-(1-beta-arabinofuranosylcytosin-5'-yl)pyrophosphate is C25H47N3O11P2.
What is the molecular weight of P(1)-(1-hexadecyl)-P(2)-(1-beta-arabinofuranosylcytosin-5'-yl)pyrophosphate?
The molecular weight of P(1)-(1-hexadecyl)-P(2)-(1-beta-arabinofuranosylcytosin-5'-yl)pyrophosphate is 627.27 g/mol.
Where can I buy P(1)-(1-hexadecyl)-P(2)-(1-beta-arabinofuranosylcytosin-5'-yl)pyrophosphate?
You can request a quote for P(1)-(1-hexadecyl)-P(2)-(1-beta-arabinofuranosylcytosin-5'-yl)pyrophosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for P(1)-(1-hexadecyl)-P(2)-(1-beta-arabinofuranosylcytosin-5'-yl)pyrophosphate?
Yes, KEHONG BIO provides custom synthesis services for P(1)-(1-hexadecyl)-P(2)-(1-beta-arabinofuranosylcytosin-5'-yl)pyrophosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.