5-(Acetyloxy)-5-(1,2-diphenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione

Base Information

• Chemical Name: 5-(Acetyloxy)-5-(1,2-diphenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
• CAS No.: 126348-50-3
• Molecular Formula: C20H18 N2 O5
• Molecular Weight: 366.3673
• DSSTox Substance ID: DTXSID70925514
• Mol file: 126348-50-3.mol

Synonyms:Acide (diphenyl-1,2 ethyl)-5 acetoxy-5 barbiturique [French];5-(Acetyloxy)-5-(1,2-diphenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione;2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(acetyloxy)-5-(1,2-diphenylethyl)-;Acide (diphenyl-1,2 ethyl)-5 acetoxy-5 barbiturique;126348-50-3;DTXSID70925514;LS-135667;5-(1,2-Diphenylethyl)-4,6-dihydroxy-2-oxo-2,5-dihydropyrimidin-5-yl acetate

Chemical Property of 5-(Acetyloxy)-5-(1,2-diphenylethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione

Chemical Property:

• PKA: 6.71±0.10(Predicted)
• PSA: 108.55000
• Density: 1.34g/cm³
• LogP: 2.23260
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 366.12157168
• Heavy Atom Count: 27
• Complexity: 586

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)OC1(C(=O)NC(=O)NC1=O)C(CC2=CC=CC=C2)C3=CC=CC=C3