Ruzotolimod
[(1S)-1-[(2S,4R,5R)-5-(5-amino-2-oxo-[1,3]thiazolo[4,5-d]pyrimidin-3-yl)-4-hydroxyoxolan-2-yl]propyl] acetate
Molecular Identity
Ruzotolimod
[(1S)-1-[(2S,4R,5R)-5-(5-amino-2-oxo-[1,3]thiazolo[4,5-d]pyrimidin-3-yl)-4-hydroxyoxolan-2-yl]propyl] acetate
PubChem CID: 122549964
2D Structure
Properties
C14H18N4O5S
Molecular Formula
354.38
Molecular Weight
g/mol
354.0998
Exact Mass
Da
0.6
XLogP
Drug-like (Lipinski: < 5)
153
TPSA
May have limited oral absorption
2
H-Bond Donors
9
H-Bond Acceptors
510
Complexity
SMILES
Canonical SMILES
SMILES: CCC(C1CC(C(O1)N2C3=NC(=NC=C3SC2=O)N)O)OC(=O)CIsomeric SMILES
SMILES: CC[C@@H]([C@@H]1C[C@H]([C@@H](O1)N2C3=NC(=NC=C3SC2=O)N)O)OC(=O)CSynonyms(20)
Ruzotolimod1948241-60-8OMW4Z1F2D4RG7854RO7020531RO-7020531RefChem:180386((1S)-1-((2S,4R,5R)-5-(5-amino-2-oxo-(1,3)thiazolo(4,5-d)pyrimidin-3-yl)-4-hydroxyoxolan-2-yl)propyl)acetateRuzotolimod [INN]UNII-OMW4Z1F2D4RG-78543-(5-O-Acetyl-3,6,7-trideoxy-alpha-L-lyxo-heptofuranosyl)-5-aminothiazolo[4,5-d]pyrimidin-2(3H)-one(1S)-1-((2S,4R,5R)-5-(5-Amino-2-oxo-(1,3)thiazolo(4,5-d)pyrimidin-3-yl)-4-hydroxyoxolan-2-yl)propyl) acetate[(1S)-1-[(2S,4R,5R)-5-(5-amino-2-oxo-[1,3]thiazolo[4,5-d]pyrimidin-3-yl)-4-hydroxyoxolan-2-yl]propyl] acetate3-(5-O-Acetyl-3,6,7-trideoxy-alpha-L-lyxo-heptofuranosyl)-5-aminothiazolo(4,5-d)pyrimidin-2(3H)-one
Data from PubChem (NCBI)
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