Mol Weight - 408.762
Smiles - CCCCN(CCCC)C(SSC(N(CCCC)CCCC)=S)=S
| Property Name | Property Value |
| Mol Name | Tetrabutylthiuram Disulfide |
| Molweight | 408.762 |
| Monoisotopic Mass | 408.176128 |
| Clogp | 6.9782 |
| Clogs | -5.426 |
| H Acceptors | 2 |
| Total Surface Area | 348.66 |
| Relative Psa | 0.28131 |
| Polar Surface Area | 121.26 |
| Druglikeness | 0.0365 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | high |
| Shape Index | 0.58333 |
| Molecular Flexibility | 0.72056 |
| Molecular Complexity | 0.55886 |
| Fragments | 1 |
| Non H Atoms | 24 |
| Non Ch Atoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bonds | 15 |
| Sp3 Atoms | 20 |
| Symmetric Atoms | 16 |
| Smiles | CCCCN(CCCC)C(SSC(N(CCCC)CCCC)=S)=S |
| InChIKey | InChI=1S/C18H36N2S4/c1-5-9-13-19(14-10-6-2)17(21)23-24-18(22)20(15-11-7-3)16-12-8-4/h5-16H2,1-4H3 |
| InChI | PGAXJQVAHDTGBB-UHFFFAOYSA-N |
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1 — Tetrabutylthiuram Disulfide | 2 — Tetrabutylthiuram Disulfide