1,2,4-Triazin-3(2H)-one, 5,6-bis(4-methoxyphenyl)-2-(2-(phenylthio)ethyl)-

Base Information

• Chemical Name: 1,2,4-Triazin-3(2H)-one, 5,6-bis(4-methoxyphenyl)-2-(2-(phenylthio)ethyl)-
• CAS No.: 102429-75-4
• Molecular Formula: C25H23 N3 O3 S
• Molecular Weight: 445.5334
• DSSTox Substance ID: DTXSID30145074
• Wikidata: Q83009440
• Mol file: 102429-75-4.mol

Synonyms:1,2,4-Triazin-3(2H)-one, 5,6-bis(4-methoxyphenyl)-2-(2-(phenylthio)ethyl)-;5,6-Bis(4-methoxyphenyl)-2-(2-(phenylthio)ethyl)-1,2,4-triazin-3(2H)-one;102429-75-4;DTXSID30145074;LS-155678

Chemical Property of 1,2,4-Triazin-3(2H)-one, 5,6-bis(4-methoxyphenyl)-2-(2-(phenylthio)ethyl)-

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 594.5°Cat760mmHg
• PKA: -0.63±0.20(Predicted)
• Flash Point: 313.3°C
• PSA: 91.54000
• Density: 1.22g/cm³
• LogP: 4.78180
• XLogP3: 5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 8
• Exact Mass: 445.14601278
• Heavy Atom Count: 32
• Complexity: 676

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)C2=NC(=O)N(N=C2C3=CC=C(C=C3)OC)CCSC4=CC=CC=C4

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