5-[3-(4-benzoylphenoxy)prop-1-ynyl]-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione

Base Information

• Chemical Name: 5-[3-(4-benzoylphenoxy)prop-1-ynyl]-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione
• CAS No.: 877643-17-9
• Molecular Formula: C25H22N2O7
• DSSTox Substance ID: DTXSID90467805
• Nikkaji Number: J2.339.751J
• Wikidata: Q82294880

Synonyms:dUY7;877643-17-9;DTXSID90467805;5-[3-(4-benzoylphenoxy)prop-1-ynyl]-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione;5-[3-(4-Benzoylphenoxy)prop-1-yn-1-yl]-2'-deoxyuridine

Chemical Property of 5-[3-(4-benzoylphenoxy)prop-1-ynyl]-1-[(2R,4S,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]pyrimidine-2,4-dione

Chemical Property:

• XLogP3: 1.7
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 7
• Exact Mass: 462.14270105
• Heavy Atom Count: 34
• Complexity: 874

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(C(OC1N2C=C(C(=O)NC2=O)C#CCOC3=CC=C(C=C3)C(=O)C4=CC=CC=C4)CO)O
• Isomeric SMILES: C1[C@@H]([C@H](O[C@H]1N2C=C(C(=O)NC2=O)C#CCOC3=CC=C(C=C3)C(=O)C4=CC=CC=C4)CO)O

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