2-Furancarboxylic acid, 5-((2,3-dioxo-4-((4-(2-pyrimidinylamino)phenyl)methyl)-1-piperazinyl)methyl)-, methyl ester

Base Information

• Chemical Name: 2-Furancarboxylic acid, 5-((2,3-dioxo-4-((4-(2-pyrimidinylamino)phenyl)methyl)-1-piperazinyl)methyl)-, methyl ester
• CAS No.: 78789-07-8
• Molecular Formula: C₂₂H₂₁N₅O₅
• Molecular Weight: 435.439
• DSSTox Substance ID: DTXSID90229304
• Wikidata: Q83109526

Synonyms:BRN 5670741;2-Furancarboxylic acid, 5-((2,3-dioxo-4-((4-(2-pyrimidinylamino)phenyl)methyl)-1-piperazinyl)methyl)-, methyl ester;78789-07-8;DTXSID90229304;C22H21N5O5;C22-H21-N5-O5;LS-70171

Chemical Property of 2-Furancarboxylic acid, 5-((2,3-dioxo-4-((4-(2-pyrimidinylamino)phenyl)methyl)-1-piperazinyl)methyl)-, methyl ester

Chemical Property:

• Vapor Pressure: 7.99E-17mmHg at 25°C
• Boiling Point: 650.9°Cat760mmHg
• Flash Point: 347.4°C
• Density: 1.398g/cm³
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 8
• Exact Mass: 435.15426879
• Heavy Atom Count: 32
• Complexity: 678

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)C1=CC=C(O1)CN2CCN(C(=O)C2=O)CC3=CC=C(C=C3)NC4=NC=CC=N4

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