2-Methyl-3-(5-methyl-1,3,4-thiadiazol-2-yl)-5-benzylidene-3,5-dihydro-4H-imidazol-4-one

Base Information

• Chemical Name: 2-Methyl-3-(5-methyl-1,3,4-thiadiazol-2-yl)-5-benzylidene-3,5-dihydro-4H-imidazol-4-one
• CAS No.: 76834-40-7
• Molecular Formula: C14H12 N4 O S
• Molecular Weight: 284.34
• Wikidata: Q76388037
• Mol file: 76834-40-7.mol

Synonyms:76834-40-7;2-Methyl-3-(5-methyl-1,3,4-thiadiazol-2-yl)-5-benzylidene-3,5-dihydro-4H-imidazol-4-one;4-Benzylidene-2-methyl-1-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-imidazol-5(4H)-one;4H-Imidazol-4-one, 3,5-dihydro-2-methyl-3-(5-methyl-1,3,4-thiadiazol-2-yl)-5-(phenylmethylene)-;LS-79966

Chemical Property of 2-Methyl-3-(5-methyl-1,3,4-thiadiazol-2-yl)-5-benzylidene-3,5-dihydro-4H-imidazol-4-one

Chemical Property:

• Vapor Pressure: 2.26E-08mmHg at 25°C
• Melting Point: 164 °C
• Boiling Point: 452.4°C at 760 mmHg
• PKA: 0.71±0.10(Predicted)
• Flash Point: 227.4°C
• Density: 1.37g/cm³
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 284.07318219
• Heavy Atom Count: 20
• Complexity: 456

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CC1=NC(=CC2=CC=CC=C2)C(=O)N1C3=NN=C(S3)C
• Isomeric SMILES: CC1=N/C(=C\C2=CC=CC=C2)/C(=O)N1C3=NN=C(S3)C

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