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Chem Dimethyl Diphenyl Thiuram Disulfide | Cheminformatics

Dimethyl Diphenyl Thiuram Disulfide


  • SKU Code: CH139669
Chemical Name - Dimethyl Diphenyl Thiuram Disulfide
Mol Weight - 364.581
Smiles - CN(C(SSC(N(C)c1ccccc1)=S)=S)c1ccccc1
Property Name Property Value
Mol NameDimethyl Diphenyl Thiuram Disulfide
Molweight364.581
Monoisotopic Mass364.019628
Clogp5.101
Clogs-5.756
H Acceptors2
Total Surface Area278.54
Relative Psa0.35212
Polar Surface Area121.26
Druglikeness0.10329
Mutagenicnone
Tumorigenichigh
Reproductive Effectivehigh
Irritanthigh
Shape Index0.63636
Molecular Flexibility0.51976
Molecular Complexity0.63297
Fragments1
Non H Atoms22
Non Ch Atoms6
Electronegative Atoms6
Rotatable Bonds5
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms12
Sp3 Atoms6
Symmetric Atoms13
SmilesCN(C(SSC(N(C)c1ccccc1)=S)=S)c1ccccc1
InChIKeyInChI=1S/C16H16N2S4/c1-17(13-9-5-3-6-10-13)15(19)21-22-16(20)18(2)14-11-7-4-8-12-14/h3-12H,1-2H3
InChIRDQQCSOIXMZZQR-UHFFFAOYSA-N

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