1-(2-Deoxy-2-fluoro-beta-D-arabinofuranosyl)-5-vinylcytosine
TL;DR: 1-(2-Deoxy-2-fluoro-beta-D-arabinofuranosyl)-5-vinylcytosine (CAS 95740-16-2) is a chemical compound with molecular formula C11H14FN3O4 and molecular weight 271.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-5-ethenyl-1-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
Also Known As: 1-(2-Deoxy-2-fluoro-beta-D-arabinofuranosyl)-5-vinylcytosine, 1-(2-Deoxy-2-fluoro-.beta.-D-arabinofuranosyl)-5-vinylcytosine, 4-Amino-1-(2-deoxy-2-fluoro-beta-D-arabinofuranosyl)-5-ethenylpyrimidin-2(1H)-one, 1-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-4-imino-5-vinyl-pyrimidin-2-one, 4-amino-5-ethenyl-1-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
| Molecular Formula | C11H14FN3O4 |
|---|---|
| Molecular Weight | 271.10 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 271.09683 |
| Heavy Atoms | 19 |
| Complexity | 465.0 |
Chemical Identifiers
| CAS Number | 95740-16-2 |
|---|---|
| SMILES | C=CC1=CN(C(=O)N=C1N)[C@H]2[C@H]([C@@H]([C@H](O2)CO)O)F |
| InChIKey | JGMINUKHOITSQF-IBCQBUCCSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(2-Deoxy-2-fluoro-beta-D-arabinofuranosyl)-5-vinylcytosine (CAS 95740-16-2), with molecular formula C11H14FN3O4 and molecular weight 271.10 g/mol. IUPAC: 4-amino-5-ethenyl-1-[(2R,3S,4R,5R)-3-fluoro-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one.
Chemical Property Profile of 1-(2-Deoxy-2-fluoro-beta-D-arabinofuranosyl)-5-vinylcytosine
Property Insights of 1-(2-Deoxy-2-fluoro-beta-D-arabinofuranosyl)-5-vinylcytosine
The XLogP value of -0.6 indicates that 1-(2-Deoxy-2-fluoro-beta-D-arabinofuranosyl)-5-vinylcytosine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Deoxy-2-fluoro-beta-D-arabinofuranosyl)-5-vinylcytosine. Following Lipinski's Rule of Five, 1-(2-Deoxy-2-fluoro-beta-D-arabinofuranosyl)-5-vinylcytosine has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(2-Deoxy-2-fluoro-beta-D-arabinofuranosyl)-5-vinylcytosine?
The CAS number of 1-(2-Deoxy-2-fluoro-beta-D-arabinofuranosyl)-5-vinylcytosine is 95740-16-2.
What is the molecular formula of 1-(2-Deoxy-2-fluoro-beta-D-arabinofuranosyl)-5-vinylcytosine?
The molecular formula of 1-(2-Deoxy-2-fluoro-beta-D-arabinofuranosyl)-5-vinylcytosine is C11H14FN3O4.
What is the molecular weight of 1-(2-Deoxy-2-fluoro-beta-D-arabinofuranosyl)-5-vinylcytosine?
The molecular weight of 1-(2-Deoxy-2-fluoro-beta-D-arabinofuranosyl)-5-vinylcytosine is 271.10 g/mol.
Where can I buy 1-(2-Deoxy-2-fluoro-beta-D-arabinofuranosyl)-5-vinylcytosine?
You can request a quote for 1-(2-Deoxy-2-fluoro-beta-D-arabinofuranosyl)-5-vinylcytosine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Deoxy-2-fluoro-beta-D-arabinofuranosyl)-5-vinylcytosine?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Deoxy-2-fluoro-beta-D-arabinofuranosyl)-5-vinylcytosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.