Pca 16
TL;DR: Pca 16 (CAS 128864-45-9) is a chemical compound with molecular formula C25H44N3O10P and molecular weight 577.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Pca 16
16-[[(2R,3S,4S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxyhexadecanoic acid
Also Known As: Pca 16, pCA16, 16-[[(2R,3S,4S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxyhexadecanoic acid, 4-Amino-1-(5-O-(((15-carboxypentadecyl)oxy)hydroxyphosphinyl)-beta-D-arabinofuranosyl)-2(1H)-pyrimidinone, 2(1H)-Pyrimidinone, 4-amino-1-(5-O-(((15-carboxypentadecyl)oxy)hydroxyphosphinyl)-beta-D-arabinofuranosyl)-
| Molecular Formula | C25H44N3O10P |
|---|---|
| Molecular Weight | 577.28 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 201.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 21 |
| Exact Mass | 577.2764 |
| Heavy Atoms | 39 |
| Complexity | 871.0 |
Chemical Identifiers
| CAS Number | 128864-45-9 |
|---|---|
| SMILES | C1=CN(C(=O)N=C1N)[C@H]2[C@H]([C@@H]([C@H](O2)COP(=O)(O)OCCCCCCCCCCCCCCCC(=O)O)O)O |
| InChIKey | AYHYONJCFYEXBP-OUJCMCIWSA-N |
Product Overview
Pca 16 (CAS 128864-45-9), with molecular formula C25H44N3O10P and molecular weight 577.28 g/mol. IUPAC: 16-[[(2R,3S,4S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]oxyhexadecanoic acid.
Chemical Property Profile of Pca 16
Property Insights of Pca 16
The XLogP value of 3.1 indicates that Pca 16 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 201.0 Ų indicates high polarity, suggesting Pca 16 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Pca 16 has 5 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Pca 16?
The CAS number of Pca 16 is 128864-45-9.
What is the molecular formula of Pca 16?
The molecular formula of Pca 16 is C25H44N3O10P.
What is the molecular weight of Pca 16?
The molecular weight of Pca 16 is 577.28 g/mol.
Where can I buy Pca 16?
You can request a quote for Pca 16 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pca 16?
Yes, KEHONG BIO provides custom synthesis services for Pca 16 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.