7,7'-Disulfanediylbis(4-methyl-2H-1,4-benzoxazin-3(4H)-one)

Base Information

• Chemical Name: 7,7'-Disulfanediylbis(4-methyl-2H-1,4-benzoxazin-3(4H)-one)
• CAS No.: 139503-11-0
• Molecular Formula: C18H16N2O4S2
• Molecular Weight: 388.468
• DSSTox Substance ID: DTXSID60706733
• Wikidata: Q82640245

Synonyms:139503-11-0;DTXSID60706733;FFPYTAUZIFHDBC-UHFFFAOYSA-N;7,7'-Disulfanediylbis(4-methyl-2H-1,4-benzoxazin-3(4H)-one);di-(4-methyl-3-oxo-2,3-dihydro-4H-1,4-benzoxazin-7-yl) disulphide

Chemical Property of 7,7'-Disulfanediylbis(4-methyl-2H-1,4-benzoxazin-3(4H)-one)

Chemical Property:

• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 388.05514934
• Heavy Atom Count: 26
• Complexity: 515

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C(=O)COC2=C1C=CC(=C2)SSC3=CC4=C(C=C3)N(C(=O)CO4)C

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