2-[[4-(3-chlorophenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-hexyl-1,3-thiazole-4-carboxamide

Base Information

• Chemical Name: 2-[[4-(3-chlorophenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-hexyl-1,3-thiazole-4-carboxamide
• CAS No.: 5948-90-3
• Molecular Formula: C20H24ClN5OS2
• Molecular Weight: 319.3803
• DSSTox Substance ID: DTXSID90974882
• Wikidata: Q82959344
• Mol file: 5948-90-3.mol

Synonyms:5948-90-3;DTXSID90974882;2-({[4-(3-Chlorophenyl)-5-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-N-hexyl-1,3-thiazole-4-carboximidic acid

Chemical Property of 2-[[4-(3-chlorophenyl)-5-methyl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-hexyl-1,3-thiazole-4-carboxamide

Chemical Property:

• Vapor Pressure: 1.03E-11mmHg at 25°C
• Boiling Point: 539.6°Cat760mmHg
• Flash Point: 280.1°C
• Density: 1.33g/cm³
• XLogP3: 5.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 10
• Exact Mass: 449.1110804
• Heavy Atom Count: 29
• Complexity: 517

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCCCCCNC(=O)C1=CSC(=N1)CSC2=NN=C(N2C3=CC(=CC=C3)Cl)C