4-(2,4-dimethylphenyl)-5-pyridin-4-yl-4H-1,2,4-triazole-3-thiol

Base Information

• Chemical Name: 4-(2,4-dimethylphenyl)-5-pyridin-4-yl-4H-1,2,4-triazole-3-thiol
• CAS No.: 675153-69-2
• Molecular Formula: C15H14N4S
• Molecular Weight: 282.4
• DSSTox Substance ID: DTXSID101139328
• ChEMBL ID: CHEMBL1525888
• Mol file: 675153-69-2.mol

Synonyms:675153-69-2;4-(2,4-dimethylphenyl)-5-(pyridin-4-yl)-4H-1,2,4-triazole-3-thiol;4-(2,4-dimethylphenyl)-5-pyridin-4-yl-4H-1,2,4-triazole-3-thiol;3H-1,2,4-Triazole-3-thione, 4-(2,4-dimethylphenyl)-2,4-dihydro-5-(4-pyridinyl)-;MLS000662586;CHEMBL1525888;DTXSID101139328;HMS2617G10;STK150125;STK853189;AKOS001689978;AKOS005630253;SMR000292500;EU-0049068;4-(2,4-dimethylphenyl)-5-(4-pyridinyl)-4H-1,2,4-triazole-3-thiol;4-(2,4-Dimethylphenyl)-2,4-dihydro-5-(4-pyridinyl)-3H-1,2,4-triazole-3-thione;4-(2,4-dimethylphenyl)-5-(pyridin-4-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

Chemical Property of 4-(2,4-dimethylphenyl)-5-pyridin-4-yl-4H-1,2,4-triazole-3-thiol

Chemical Property:

• XLogP3: 2.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 282.09391764
• Heavy Atom Count: 20
• Complexity: 403

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MSDS Files:

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• Canonical SMILES: CC1=CC(=C(C=C1)N2C(=NNC2=S)C3=CC=NC=C3)C

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