1,3,4-Thiadiazole, 2,3-dihydro-2-(4-nitrophenyl)-5-(phenylmethyl)-

Base Information

• Chemical Name: 1,3,4-Thiadiazole, 2,3-dihydro-2-(4-nitrophenyl)-5-(phenylmethyl)-
• CAS No.: 90057-58-2
• Molecular Formula: C15H13N3O2S
• DSSTox Substance ID: DTXSID20386338

Synonyms:90057-58-2;1,3,4-Thiadiazole, 2,3-dihydro-2-(4-nitrophenyl)-5-(phenylmethyl)-;5-benzyl-2-(4-nitrophenyl)-2,3-dihydro-1,3,4-thiadiazole;CBMicro_048449;WBUDSFZVSCFEFR-UHFFFAOYSA-;DTXSID20386338;BIM-0048356.P001;SR-01000216466;SR-01000216466-1;InChI=1/C15H13N3O2S/c19-18(20)13-8-6-12(7-9-13)15-17-16-14(21-15)10-11-4-2-1-3-5-11/h1-9,15,17H,10H2

Chemical Property of 1,3,4-Thiadiazole, 2,3-dihydro-2-(4-nitrophenyl)-5-(phenylmethyl)-

Chemical Property:

• XLogP3: 3.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 299.07284784
• Heavy Atom Count: 21
• Complexity: 396

Purity/Quality:

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CC2=NNC(S2)C3=CC=C(C=C3)[N+](=O)[O-]

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