AC1LA4TB
4-amino-1-[(2R,4S,5R)-5-ethynyl-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-fluoropyrimidin-2-one
Also Known As: 2'-deoxy-4'-ethynyl-5-fluorocytidine|4'-Ethynyl-2'-deoxy-5-fluorocytidine|2'-Deoxy-4'-C-ethynyl-5-fluorocytidine|4 -Ethynyl-5-fluoro-2 -deoxycytidine|J1.437.737I|4 -C-Ethynyl-2 -deoxy-5-fluorocytidine|1-(2-Deoxy-4-C-ethynyl-beta-D-ribo-pentofuranosyl)-5-fluorocytosine|1-(4-C-Ethynyl-2-deoxy-beta-D-ribo-pentofuranosyl)-5-fluorocytosine|1-[4alpha-Hydroxy-5beta-(hydroxymethyl)-5-ethynyltetrahydrofuran-2beta-yl]-4-amino-5-fluoropyrimidine-2(1H)-one|4-amino-1-[(2R,4S,5R)-5-ethynyl-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-fluoro-1,2-dihydropyrimidin-2-one|4-amino-1-[(2R,4S,5R)-5-ethynyl-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-fluoropyrimidin-2-one|4-amino-1-[(2R,4S,5R)-5-ethynyl-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-fluoro-pyrimidin-2-one
| Molecular Formula | C11H12FN3O4 |
|---|---|
| Molecular Weight | 269.08118 g/mol |
| LogP | -1.4 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.08118 |
| Monoisotopic Mass | 269.08118 |
| Heavy Atoms | 19 |
| Complexity | 523.0 |
Chemical Identifiers
| CAS Number | 311348-99-9 |
|---|---|
| SMILES | C#C[C@]1([C@H](C[C@@H](O1)N2C=C(C(=NC2=O)N)F)O)CO |
| InChIKey | NFKCHWDAWIBZKR-VAOFZXAKSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
AC1LA4TB (CAS 311348-99-9), with molecular formula C11H12FN3O4 and molecular weight 269.08118 g/mol. IUPAC: 4-amino-1-[(2R,4S,5R)-5-ethynyl-4-hydroxy-5-(hydroxymethyl)oxolan-2-yl]-5-fluoropyrimidin-2-one.
AC1LA4TB is a custom synthesis product. We offer services from milligram to kilogram scale.
Request a Quote »