(5E)-5-{[1-(2,4-dichlorobenzyl)-1H-indol-3-yl]methylene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one

Base Information

• Chemical Name: (5E)-5-{[1-(2,4-dichlorobenzyl)-1H-indol-3-yl]methylene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one
• CAS No.: 6235-67-2
• Molecular Formula: C21H16Cl2N2OS2
• Molecular Weight: 447.4005
• DSSTox Substance ID: DTXSID30367552
• Wikidata: Q82153470

Synonyms:6235-67-2;BAS 13120273;DTXSID30367552;AKOS000412278;(5E)-5-{[1-(2,4-dichlorobenzyl)-1H-indol-3-yl]methylene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one

Chemical Property of (5E)-5-{[1-(2,4-dichlorobenzyl)-1H-indol-3-yl]methylene}-3-ethyl-2-thioxo-1,3-thiazolidin-4-one

Chemical Property:

• Vapor Pressure: 3.87E-15mmHg at 25°C
• Boiling Point: 616.7°Cat760mmHg
• Flash Point: 326.8°C
• Density: 1.41g/cm³
• XLogP3: 6.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 446.0081109
• Heavy Atom Count: 28
• Complexity: 658

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN1C(=O)C(=CC2=CN(C3=CC=CC=C32)CC4=C(C=C(C=C4)Cl)Cl)SC1=S
• Isomeric SMILES: CCN1C(=O)/C(=C\C2=CN(C3=CC=CC=C32)CC4=C(C=C(C=C4)Cl)Cl)/SC1=S

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