3'-FddEtU (alpha)
TL;DR: 3'-FddEtU (alpha) (CAS 120713-83-9) is a chemical compound with molecular formula C11H15FN2O4 and molecular weight 258.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethyl-1-[(2S,4S,5R)-4-fluoro-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione
Also Known As: 3'-FddEtU (alpha), FLEU, VSA 411, 2,4(1H,3H)-Pyrimidinedione, 1-(2,3-dideoxy-3-fluoro-alpha-D-erythro-pentofuranosyl)-5-ethyl-, 1-(3'-Fluoro-2',3'-dideoxy-alpha-D-ribofuranosyl)-5-ethyluracil
| Molecular Formula | C11H15FN2O4 |
|---|---|
| Molecular Weight | 258.10 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 78.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.1016 |
| Heavy Atoms | 18 |
| Complexity | 399.0 |
Chemical Identifiers
| CAS Number | 120713-83-9 |
|---|---|
| SMILES | CCC1=CN(C(=O)NC1=O)[C@@H]2C[C@@H]([C@H](O2)CO)F |
| InChIKey | SSFQGWVTTOGGKN-YIZRAAEISA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3'-FddEtU (alpha) (CAS 120713-83-9), with molecular formula C11H15FN2O4 and molecular weight 258.10 g/mol. IUPAC: 5-ethyl-1-[(2S,4S,5R)-4-fluoro-5-(hydroxymethyl)oxolan-2-yl]pyrimidine-2,4-dione.
Chemical Property Profile of 3'-FddEtU (alpha)
Property Insights of 3'-FddEtU (alpha)
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3'-FddEtU (alpha). The TPSA of 78.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3'-FddEtU (alpha). Following Lipinski's Rule of Five, 3'-FddEtU (alpha) has 2 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 3'-FddEtU (alpha)?
The CAS number of 3'-FddEtU (alpha) is 120713-83-9.
What is the molecular formula of 3'-FddEtU (alpha)?
The molecular formula of 3'-FddEtU (alpha) is C11H15FN2O4.
What is the molecular weight of 3'-FddEtU (alpha)?
The molecular weight of 3'-FddEtU (alpha) is 258.10 g/mol.
Where can I buy 3'-FddEtU (alpha)?
You can request a quote for 3'-FddEtU (alpha) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3'-FddEtU (alpha)?
Yes, KEHONG BIO provides custom synthesis services for 3'-FddEtU (alpha) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.