3-{4-[(3-Chlorophenyl)methyl]piperazin-1-yl}-1H-1,2,4-triazol-5-amine

Base Information

• Chemical Name: 3-{4-[(3-Chlorophenyl)methyl]piperazin-1-yl}-1H-1,2,4-triazol-5-amine
• CAS No.: 89293-04-9
• Molecular Formula: C13H17ClN6
• Molecular Weight: 292.76700
• ChEMBL ID: CHEMBL155655
• DSSTox Substance ID: DTXSID30533255
• Wikidata: Q82406441

Synonyms:89293-04-9;CHEMBL155655;SCHEMBL11200656;SCHEMBL16825908;DTXSID30533255;3-{4-[(3-Chlorophenyl)methyl]piperazin-1-yl}-1H-1,2,4-triazol-5-amine

Chemical Property of 3-{4-[(3-Chlorophenyl)methyl]piperazin-1-yl}-1H-1,2,4-triazol-5-amine

Chemical Property:

• PSA: 74.80000
• LogP: 1.29550
• XLogP3: 2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 292.1203223
• Heavy Atom Count: 20
• Complexity: 309

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CCN1CC2=CC(=CC=C2)Cl)C3=NNC(=N3)N

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