Thioperamide

Base Information

Chemical Name:Thioperamide
CAS No.:106243-16-7
Molecular Formula:C15H24 N4 S
Molecular Weight:408.522
Hs Code.:2933990090
UNII:II4319BWUI
DSSTox Substance ID:DTXSID50147555
Nikkaji Number:J248.127H
Wikipedia:Thioperamide
Wikidata:Q7784686
Pharos Ligand ID:AA4F5ML2KBWY
ChEMBL ID:CHEMBL260374
Mol file:106243-16-7.mol

Synonyms:MR 12842;MR-12842;N-cyclohexy-4-(imidazol-4-yl)-1-piperidinecarbothioamide;thioperamide

Suppliers and Price of Thioperamide

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Usbiological
Thioperamide
10mg
$ 389.00

TRC
Thioperamide
10mg
$ 110.00

Tocris
Thioperamide ≥99%(HPLC)
50
$ 515.00

Tocris
Thioperamide ≥99%(HPLC)
10
$ 123.00

Sigma-Aldrich
Thioperamide maleate salt solid
100 mg
$ 796.00

Sigma-Aldrich
Thioperamide maleate salt solid
10 mg
$ 109.00

Sigma-Aldrich
Thioperamide maleate salt solid
25 mg
$ 262.00

Crysdot
Thioperamide 97%
25mg
$ 325.00

Crysdot
Thioperamide 97%
5mg
$ 85.00

Crysdot
Thioperamide 97%
10mg
$ 145.00

Total 26 raw suppliers

Chemical Property of Thioperamide

Chemical Property:

Appearance/Colour:White Solid
Vapor Pressure:4.12E-10mmHg at 25°C
Boiling Point:499.5 °C at 760 mmHg
Flash Point:255.9 °C
PSA：150.64000
Density:1.2 g/cm³
LogP:2.83690
Storage Temp.:Store at -20°C
Solubility.:H2O: 10 mg/mL
XLogP3:2.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:292.17216796
Heavy Atom Count:20
Complexity:322

Purity/Quality:

97% ^*data from raw suppliers

Thioperamide ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26-36

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CCC(CC1)NC(=S)N2CCC(CC2)C3=CN=CN3
Uses Thioperamide is a highly potent and selective ligand for histamine H3-receptors.

Technology Process of Thioperamide

There total 8 articles about Thioperamide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 87.0%

: 106243-23-6
4-(1H-imidazol-4-yl)-piperidine

: 1122-82-3
isothiocyanatocyclohexane

: 106243-16-7
thioperamide

Guidance literature:: In toluene; for 2h; Heating;
DOI:10.1021/jm00017a018

Reference yield:

: 79099-07-3
N-tert-butyloxycarbonylpiperidin-4-one

: 106243-16-7
thioperamide

Guidance literature:: Multi-step reaction with 4 steps

1: 1.) n-BuLi in hexane / 1.) THF, 1.5 h, 10-15 deg C, 2.) THF, room temperature

2: 97 percent / concd. aq. HCl / 40 h / 95 °C

3: 88 percent / hydrogen / PtO₂ / acetic acid; H₂O / 24 h / 2585.7 Torr / Ambient temperature

4: 1.) NaOH / 1.) methanol, 30 min, 2.) acetonitrile, 2 h, 50 deg C; 40 h, room temperature

With hydrogenchloride; sodium hydroxide; n-butyllithium; hydrogen; platinum(IV) oxide; In water; acetic acid;
DOI:10.1016/0040-4020(95)00881-8

Reference yield:

: 173469-30-2
4-<4-(4-hydroxy-1-tert-butoxycarbonyl)piperidyl>-(1H)-imidazole

: 106243-16-7
thioperamide

Guidance literature:: Multi-step reaction with 3 steps

1: 97 percent / concd. aq. HCl / 40 h / 95 °C

2: 88 percent / hydrogen / PtO₂ / acetic acid; H₂O / 24 h / 2585.7 Torr / Ambient temperature

3: 1.) NaOH / 1.) methanol, 30 min, 2.) acetonitrile, 2 h, 50 deg C; 40 h, room temperature

With hydrogenchloride; sodium hydroxide; hydrogen; platinum(IV) oxide; In water; acetic acid;
DOI:10.1016/0040-4020(95)00881-8