1-(2,3-dideoxy-3-fluoro-beta-erythro-pentofuranosyl)-2-ethoxypyrimidin-4(1H)-one
TL;DR: 1-(2,3-dideoxy-3-fluoro-beta-erythro-pentofuranosyl)-2-ethoxypyrimidin-4(1H)-one (CAS 171109-36-7) 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.
2-ethoxy-1-[(2R,4S,5R)-4-fluoro-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-4-one
Also Known As: 2',3'-Dideoxy-2-O-ethyl-3'-fluorouridine, uridine, 2',3'-dideoxy-2-O-ethyl-3'-fluoro-, 1-(2,3-dideoxy-3-fluoro-beta-erythro-pentofuranosyl)-2-ethoxypyrimidin-4(1H)-one, 2-ethoxy-1-[(2R,4S,5R)-4-fluoro-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-4-one, 4(1H)-pyrimidinone, 1-(2,3-dideoxy-3-fluoro-beta-D-erythro-pentofuranosyl)-2-ethoxy-
| Molecular Formula | C11H15FN2O4 |
|---|---|
| Molecular Weight | 258.10 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 71.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 258.1016 |
| Heavy Atoms | 18 |
| Complexity | 385.0 |
Chemical Identifiers
| CAS Number | 171109-36-7 |
|---|---|
| SMILES | CCOC1=NC(=O)C=CN1[C@H]2C[C@@H]([C@H](O2)CO)F |
| InChIKey | DGGKKQBJAFQUTR-QXFUBDJGSA-N |
Product Overview
1-(2,3-dideoxy-3-fluoro-beta-erythro-pentofuranosyl)-2-ethoxypyrimidin-4(1H)-one (CAS 171109-36-7), with molecular formula C11H15FN2O4 and molecular weight 258.10 g/mol. IUPAC: 2-ethoxy-1-[(2R,4S,5R)-4-fluoro-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-4-one.
Chemical Property Profile of 1-(2,3-dideoxy-3-fluoro-beta-erythro-pentofuranosyl)-2-ethoxypyrimidin-4(1H)-one
Property Insights of 1-(2,3-dideoxy-3-fluoro-beta-erythro-pentofuranosyl)-2-ethoxypyrimidin-4(1H)-one
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2,3-dideoxy-3-fluoro-beta-erythro-pentofuranosyl)-2-ethoxypyrimidin-4(1H)-one. The TPSA of 71.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2,3-dideoxy-3-fluoro-beta-erythro-pentofuranosyl)-2-ethoxypyrimidin-4(1H)-one. Following Lipinski's Rule of Five, 1-(2,3-dideoxy-3-fluoro-beta-erythro-pentofuranosyl)-2-ethoxypyrimidin-4(1H)-one has 1 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-(2,3-dideoxy-3-fluoro-beta-erythro-pentofuranosyl)-2-ethoxypyrimidin-4(1H)-one?
The CAS number of 1-(2,3-dideoxy-3-fluoro-beta-erythro-pentofuranosyl)-2-ethoxypyrimidin-4(1H)-one is 171109-36-7.
What is the molecular formula of 1-(2,3-dideoxy-3-fluoro-beta-erythro-pentofuranosyl)-2-ethoxypyrimidin-4(1H)-one?
The molecular formula of 1-(2,3-dideoxy-3-fluoro-beta-erythro-pentofuranosyl)-2-ethoxypyrimidin-4(1H)-one is C11H15FN2O4.
What is the molecular weight of 1-(2,3-dideoxy-3-fluoro-beta-erythro-pentofuranosyl)-2-ethoxypyrimidin-4(1H)-one?
The molecular weight of 1-(2,3-dideoxy-3-fluoro-beta-erythro-pentofuranosyl)-2-ethoxypyrimidin-4(1H)-one is 258.10 g/mol.
Where can I buy 1-(2,3-dideoxy-3-fluoro-beta-erythro-pentofuranosyl)-2-ethoxypyrimidin-4(1H)-one?
You can request a quote for 1-(2,3-dideoxy-3-fluoro-beta-erythro-pentofuranosyl)-2-ethoxypyrimidin-4(1H)-one 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-3-fluoro-beta-erythro-pentofuranosyl)-2-ethoxypyrimidin-4(1H)-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,3-dideoxy-3-fluoro-beta-erythro-pentofuranosyl)-2-ethoxypyrimidin-4(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.