3-ethyl-6-iodo-2-thioxo-2,3-dihydroquinazolin-4(1H)-one

Base Information

• Chemical Name: 3-ethyl-6-iodo-2-thioxo-2,3-dihydroquinazolin-4(1H)-one
• CAS No.: 111631-31-3
• Molecular Formula: C10H9IN2OS
• Molecular Weight: 332.16100
• DSSTox Substance ID: DTXSID70359158
• Wikidata: Q82140217
• Mol file: 111631-31-3.mol

Synonyms:111631-31-3;3-ethyl-6-iodo-2-thioxo-2,3-dihydroquinazolin-4(1H)-one;STK563332;SCHEMBL5712373;DTXSID70359158;AKOS005489374;AKOS030516192;3-ethyl-6-iodo-2-mercaptoquinazolin-4(3H)-one;3-ethyl-6-iodo-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-one

Chemical Property of 3-ethyl-6-iodo-2-thioxo-2,3-dihydroquinazolin-4(1H)-one

Chemical Property:

• PSA: 73.69000
• LogP: 2.30970
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 331.94803
• Heavy Atom Count: 15
• Complexity: 297

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN1C(=O)C2=C(C=CC(=C2)I)NC1=S

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