1-(2,3-Dideoxy-2-fluoropentofuranosyl)cytosine
TL;DR: 1-(2,3-Dideoxy-2-fluoropentofuranosyl)cytosine (CAS 119555-47-4) is a chemical compound with molecular formula C9H12FN3O3 and molecular weight 229.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-amino-1-[(2R,3S,5S)-3-fluoro-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one
Also Known As: FddC, 2'betaFddC, 2,3-Ddfpc, 2'-F-dd-Ara-C, 2'-F-ddaraC
| Molecular Formula | C9H12FN3O3 |
|---|---|
| Molecular Weight | 229.09 g/mol |
| LogP | -0.9 |
| Topological Polar Surface Area | 88.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 229.08627 |
| Heavy Atoms | 16 |
| Complexity | 358.0 |
Chemical Identifiers
| CAS Number | 119555-47-4 |
|---|---|
| SMILES | C1[C@H](O[C@H]([C@H]1F)N2C=CC(=NC2=O)N)CO |
| InChIKey | LTDCCBLBAQXNKP-VMHSAVOQSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(2,3-Dideoxy-2-fluoropentofuranosyl)cytosine (CAS 119555-47-4), with molecular formula C9H12FN3O3 and molecular weight 229.09 g/mol. IUPAC: 4-amino-1-[(2R,3S,5S)-3-fluoro-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one.
Chemical Property Profile of 1-(2,3-Dideoxy-2-fluoropentofuranosyl)cytosine
Property Insights of 1-(2,3-Dideoxy-2-fluoropentofuranosyl)cytosine
The XLogP value of -0.9 indicates that 1-(2,3-Dideoxy-2-fluoropentofuranosyl)cytosine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 88.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,3-Dideoxy-2-fluoropentofuranosyl)cytosine. Following Lipinski's Rule of Five, 1-(2,3-Dideoxy-2-fluoropentofuranosyl)cytosine has 2 hydrogen bond donor(s) and 4 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-(2,3-Dideoxy-2-fluoropentofuranosyl)cytosine?
The CAS number of 1-(2,3-Dideoxy-2-fluoropentofuranosyl)cytosine is 119555-47-4.
What is the molecular formula of 1-(2,3-Dideoxy-2-fluoropentofuranosyl)cytosine?
The molecular formula of 1-(2,3-Dideoxy-2-fluoropentofuranosyl)cytosine is C9H12FN3O3.
What is the molecular weight of 1-(2,3-Dideoxy-2-fluoropentofuranosyl)cytosine?
The molecular weight of 1-(2,3-Dideoxy-2-fluoropentofuranosyl)cytosine is 229.09 g/mol.
Where can I buy 1-(2,3-Dideoxy-2-fluoropentofuranosyl)cytosine?
You can request a quote for 1-(2,3-Dideoxy-2-fluoropentofuranosyl)cytosine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,3-Dideoxy-2-fluoropentofuranosyl)cytosine?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,3-Dideoxy-2-fluoropentofuranosyl)cytosine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.