Basic information
- CAS
26087-98-9- Standard SMILES
CN1CCCN(C(=S)SSC(=S)N2CCCN(C)CC2)CC1- InChIKey
NXJOFTRBTBDSHB-UHFFFAOYSA-N- Molecular formula
- C14H26N4S4
- Average molar mass
- 378.7 g/mol
- Monoisotopic mass
- 378.10403154
Names & identifiers
- Preferred name
- 1H-1,4-Diazepine, 1,1'-(dithiodicarbonothioyl)bis(hexahydro-4-methyl-
- IUPAC
- (4-methyl-1,4-diazepane-1-carbothioyl)sulfanyl 4-methyl-1,4-diazepane-1-carbodithioate
- English name
- Bis (4-methyl-1-homo-piperazinylthiocarbonyl) disulfide
- Molecular formula
- C14H26N4S4
- Molecular weight
- 378.64
Names & synonyms
26087-98-9Fla 63FLA-636XX8M7P9DCDTXSID001807151H-1,4-Diazepine, 1,1'-(dithiodicarbonothioyl)bis(hexahydro-4-methyl-DISULFIDE, BIS((HEXAHYDRO-4-METHYL-1H-1,4-DIAZEPIN-1-YL)THIOCARBONYL)1H-1,4-Diazepine, 1,1'-(dithiodicarbonothioyl)bis[hexahydro-4-methyl-RefChem:908324DTXCID40103206247-450-6Bis((hexahydro-4-methyl-1H-1,4-diazepin-1-yl)thiocarbonyl)disulfide
Show more names
Bis-(4-Methyl-1-Piperazinylthiocarbonyl)DisulphideBis (4-methyl-1-homo-piperazinylthiocarbonyl) disulfidebis(4-methyl-4-aza-1,1-hexamethylene)thiuram disulphideBis(4-methyl-1-homopiperazinylthiocarbonyl)disulfide,99%1,1’-(dithiodicarbonothioyl)bis(hexahydro-4-methyl-1h-4-diazepineBis(4-methylhexahydro-1H-1,4-diazepine-1-ylcarbonothioyl) persulfide1,1'-(Dithiodicarbonothioyl)bis(hexahydro-4-methyl-1H-1,4-diazepine)disulfide,bis((hexahydro-4-methyl-1h-1,4-diazepin-1-yl)thiocarbonyl)
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 128 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 357
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Melting point
- 142 °C · 142°C
- Density
- 1.329 · 1.3290 (rough estimate)
- refractive index
- 1.57 · 1.5700 (estimate)
- FDA UNII
- 6 XX8M7P9DC · 6XX8M7P9DC
Chemistry & industry
Applications
Usesbis-(4-Methyl-1-homopiperazinylthiocarbonyl)disulfide is a dopamine β-hydroxylase inhibitor. Also, it is a noradrenergic agents which shortens the latency of seizures induced by chloroquine.
Upstream & downstream products
Upstream raw materials
Suppliers5 total
成都思天德生物科技有限公司028-83243028 19136088901 · [email protected]
安耐吉化学&3A（安徽泽升科技股份有限公司）400-0056266 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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