3-Amino-2-(1-hydroxyheptadecyl)quinazolin-4(3H)-one

Base Information

• Chemical Name: 3-Amino-2-(1-hydroxyheptadecyl)quinazolin-4(3H)-one
• CAS No.: 917764-64-8
• Molecular Formula: C₂₅H₄₁N₃O₂
• Molecular Weight: 415.619
• DSSTox Substance ID: DTXSID30582223
• Nikkaji Number: J2.384.065K

Synonyms:917764-64-8;3-Amino-2-(1-hydroxyheptadecyl)quinazolin-4(3H)-one;3-amino-2-(1-hydroxyheptadecyl)-3,4-dihydroquinazolin-4-one;DTXSID30582223

Chemical Property of 3-Amino-2-(1-hydroxyheptadecyl)quinazolin-4(3H)-one

Chemical Property:

• Melting Point: 92-94 °C(Solv: ethanol (64-17-5))
• Boiling Point: 561.5±52.0 °C(Predicted)
• PSA: 81.14000
• Density: 1.08±0.1 g/cm3(Predicted)
• LogP: 6.59630
• XLogP3: 8.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 16
• Exact Mass: 415.31987756
• Heavy Atom Count: 30
• Complexity: 509

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCC(C1=NC2=CC=CC=C2C(=O)N1N)O

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