Valopicitabine
[(2R,3R,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-4-hydroxy-2-(hydroxymethyl)-4-methyloxolan-3-yl] (2S)-2-amino-3-methylbutanoate
Also Known As: Valopicitabine|valopicitabina|valopicitabinum|val-mCyd|Valopicitabine [INN]|NM-283|NM283|Valopicitabine dihydrochloride|NMC-283|2'-C-methylcytidine 3'-O-L-valinyl ester|2'-C-Methyl-3'-O-L-valylcytidine|2'-C-methylcytidine 3'-O-valinyl ester|2 -C-Methyl-3 -O-valylcytidine|J2.450.486G|L-Valine, 3'-ester with 2'-C-methylcytidine|2'-C-methyl-3'-O-(L-valinyl)-.beta.-D-cytidine|2'-C-Methyl-3'-O-valinylcytidine dihydrochloride salt|[(2R,3R,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-4-hydroxy-2-(hydroxymethyl)-4-methyloxolan-3-yl] (2S)-2-amino-3-methylbutanoate|(2R,3R,4R,5R)-5-(4-amino-2-oxo-1,2-dihydropyrimidin-1-yl)-4-hydroxy-2-(hydroxymethyl)-4-methyloxolan-3-yl (2S)-2-amino-3-methylbutanoate|[(2R,3R,4R,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-4-hydroxy-2-(hydroxymethyl)-4-methyl-tetrahydrofuran-3-yl] (2S)-2-amino-3-methyl-butanoate
| Molecular Formula | C15H24N4O6 |
|---|---|
| Molecular Weight | 356.1696 g/mol |
| LogP | -1.6387 |
| Topological Polar Surface Area | 162.92 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 356.1696 |
| Monoisotopic Mass | 356.1696 |
| Heavy Atoms | 25 |
| Complexity | 688.8443 |
Chemical Identifiers
| CAS Number | 640281-90-9 |
|---|---|
| SMILES | CC(C)[C@@H](C(=O)O[C@@H]1[C@H](O[C@H]([C@]1(C)O)N2C=CC(=NC2=O)N)CO)N |
Product Overview
Valopicitabine (CAS 640281-90-9), with molecular formula C15H24N4O6 and molecular weight 356.1696 g/mol. IUPAC: [(2R,3R,4R,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-4-hydroxy-2-(hydroxymethyl)-4-methyloxolan-3-yl] (2S)-2-amino-3-methylbutanoate.
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