Mol Weight - 364.581
Smiles - CN(C(SSC(N(C)c1ccccc1)=S)=S)c1ccccc1
| Property Name | Property Value |
| Mol Name | Dimethyl Diphenyl Thiuram Disulfide |
| Molweight | 364.581 |
| Monoisotopic Mass | 364.019628 |
| Clogp | 5.101 |
| Clogs | -5.756 |
| H Acceptors | 2 |
| Total Surface Area | 278.54 |
| Relative Psa | 0.35212 |
| Polar Surface Area | 121.26 |
| Druglikeness | 0.10329 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | high |
| Shape Index | 0.63636 |
| Molecular Flexibility | 0.51976 |
| Molecular Complexity | 0.63297 |
| Fragments | 1 |
| Non H Atoms | 22 |
| Non Ch Atoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bonds | 5 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3 Atoms | 6 |
| Symmetric Atoms | 13 |
| Smiles | CN(C(SSC(N(C)c1ccccc1)=S)=S)c1ccccc1 |
| InChIKey | InChI=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 |
| InChI | RDQQCSOIXMZZQR-UHFFFAOYSA-N |
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1 — Dimethyl Diphenyl Thiuram Disulfide | 2 — Dimethyl Diphenyl Thiuram Disulfide