5H-1,2,4-Triazino[5,6-b]indole, 5-ethyl-3-[(phenylmethyl)thio]-

Base Information

• Chemical Name: 5H-1,2,4-Triazino[5,6-b]indole, 5-ethyl-3-[(phenylmethyl)thio]-
• CAS No.: 112800-84-7
• Molecular Formula: C18H16N4S
• DSSTox Substance ID: DTXSID70415480
• Wikidata: Q82224425
• ChEMBL ID: CHEMBL1409196

Synonyms:MLS000115384;112800-84-7;5H-1,2,4-Triazino[5,6-b]indole, 5-ethyl-3-[(phenylmethyl)thio]-;HMS2257N05;Cambridge id 5915343;Oprea1_583960;Oprea1_782308;CHEMBL1409196;DTXSID70415480;AKOS001681807;CCG-118251;SMR000092507;AB00100664-01;3-(benzylthio)-5-ethyl-5H-[1,2,4]triazino[5,6-b]indole

Chemical Property of 5H-1,2,4-Triazino[5,6-b]indole, 5-ethyl-3-[(phenylmethyl)thio]-

Chemical Property:

• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 320.10956770
• Heavy Atom Count: 23
• Complexity: 387

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN1C2=CC=CC=C2C3=C1N=C(N=N3)SCC4=CC=CC=C4

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