Fluoroethylcytidine
TL;DR: Fluoroethylcytidine (CAS 76628-79-0) is a chemical compound with molecular formula C11H18FN3O5 and molecular weight 291.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-amino-3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-(2-fluoroethyl)-4H-pyrimidin-2-one
Also Known As: Fluoroethylcytidine, 3-(2-fluoroethyl)cytidine, 3-(2-Fluoroethyl)-3,6-dihydrocytidine, Cytidine, N,4-didehydro-3-(2-fluoroethyl)-3,4-dihydro-, 6-amino-3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-(2-fluoroethyl)-4H-pyrimidin-2-one
| Molecular Formula | C11H18FN3O5 |
|---|---|
| Molecular Weight | 291.12 g/mol |
| LogP | -1.9 |
| Topological Polar Surface Area | 119.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 291.12305 |
| Heavy Atoms | 20 |
| Complexity | 408.0 |
Chemical Identifiers
| CAS Number | 76628-79-0 |
|---|---|
| SMILES | C1C=C(N(C(=O)N1[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O)CCF)N |
| InChIKey | GWMCIZXKJHEBLD-PEBGCTIMSA-N |
Product Overview
Fluoroethylcytidine (CAS 76628-79-0), with molecular formula C11H18FN3O5 and molecular weight 291.12 g/mol. IUPAC: 6-amino-3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-1-(2-fluoroethyl)-4H-pyrimidin-2-one.
Chemical Property Profile of Fluoroethylcytidine
Property Insights of Fluoroethylcytidine
The XLogP value of -1.9 indicates that Fluoroethylcytidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 119.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Fluoroethylcytidine. Following Lipinski's Rule of Five, Fluoroethylcytidine has 4 hydrogen bond donor(s) and 7 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 Fluoroethylcytidine?
The CAS number of Fluoroethylcytidine is 76628-79-0.
What is the molecular formula of Fluoroethylcytidine?
The molecular formula of Fluoroethylcytidine is C11H18FN3O5.
What is the molecular weight of Fluoroethylcytidine?
The molecular weight of Fluoroethylcytidine is 291.12 g/mol.
Where can I buy Fluoroethylcytidine?
You can request a quote for Fluoroethylcytidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Fluoroethylcytidine?
Yes, KEHONG BIO provides custom synthesis services for Fluoroethylcytidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.