N(4)-Octadecyl-1-arabinofuranosylcytosine
TL;DR: N(4)-Octadecyl-1-arabinofuranosylcytosine (CAS 158233-67-1) is a chemical compound with molecular formula C27H49N3O5 and molecular weight 495.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-(octadecylamino)pyrimidin-2-one
Also Known As: NOAC, NOAC-octadecyl, Stearyl Ara-C, NO-AraC, N4-Stearyl-Ara C
| Molecular Formula | C27H49N3O5 |
|---|---|
| Molecular Weight | 495.37 g/mol |
| LogP | 7.1 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 20 |
| Exact Mass | 495.36722 |
| Heavy Atoms | 35 |
| Complexity | 642.0 |
Chemical Identifiers
| CAS Number | 158233-67-1 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCNC1=NC(=O)N(C=C1)[C@H]2[C@H]([C@@H]([C@H](O2)CO)O)O |
| InChIKey | HQHQCEKUGWOYPS-URBBEOKESA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N(4)-Octadecyl-1-arabinofuranosylcytosine (CAS 158233-67-1), with molecular formula C27H49N3O5 and molecular weight 495.37 g/mol. IUPAC: 1-[(2R,3S,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-4-(octadecylamino)pyrimidin-2-one.
Chemical Property Profile of N(4)-Octadecyl-1-arabinofuranosylcytosine
Property Insights of N(4)-Octadecyl-1-arabinofuranosylcytosine
The XLogP value of 7.1 indicates that N(4)-Octadecyl-1-arabinofuranosylcytosine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N(4)-Octadecyl-1-arabinofuranosylcytosine. Following Lipinski's Rule of Five, N(4)-Octadecyl-1-arabinofuranosylcytosine has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N(4)-Octadecyl-1-arabinofuranosylcytosine?
The CAS number of N(4)-Octadecyl-1-arabinofuranosylcytosine is 158233-67-1.
What is the molecular formula of N(4)-Octadecyl-1-arabinofuranosylcytosine?
The molecular formula of N(4)-Octadecyl-1-arabinofuranosylcytosine is C27H49N3O5.
What is the molecular weight of N(4)-Octadecyl-1-arabinofuranosylcytosine?
The molecular weight of N(4)-Octadecyl-1-arabinofuranosylcytosine is 495.37 g/mol.
Where can I buy N(4)-Octadecyl-1-arabinofuranosylcytosine?
You can request a quote for N(4)-Octadecyl-1-arabinofuranosylcytosine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N(4)-Octadecyl-1-arabinofuranosylcytosine?
Yes, KEHONG BIO provides custom synthesis services for N(4)-Octadecyl-1-arabinofuranosylcytosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.