3-Bromo-6-(methylthio)-1H-pyrazolo[3,4-D]pyrimidine

Base Information

Chemical Name:3-Bromo-6-(methylthio)-1H-pyrazolo[3,4-D]pyrimidine
CAS No.:1306829-95-7
Molecular Formula:C6H5BrN4S
Molecular Weight:245.103
Hs Code.:
European Community (EC) Number:889-778-8
Nikkaji Number:J2.975.824G
Mol file:1306829-95-7.mol

Synonyms:1306829-95-7;3-BROMO-6-(METHYLTHIO)-1H-PYRAZOLO[3,4-D]PYRIMIDINE;3-bromo-6-(methylsulfanyl)-1H-pyrazolo[3,4-d]pyrimidine;3-bromo-6-methylsulfanyl-2H-pyrazolo[3,4-d]pyrimidine;3-BROMO-6-(METHYLTHIO)-1H-PYRAZOLO[3,4-D]PYRIMIDIN;1H-Pyrazolo[3,4-d]pyrimidine, 3-bromo-6-(methylthio)-;SCHEMBL2598016;SCHEMBL17163938;MFCD22415216;AKOS022187702;PB19776;AS-34596;CS-0051460;A888686;1h-pyrazolo[3,4-d]pyrimidine,3-bromo-6-(methylthio)-

Suppliers and Price of 3-Bromo-6-(methylthio)-1H-pyrazolo[3,4-D]pyrimidine

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

TRC
3-Bromo-6-(methylthio)-1H-pyrazolo[3,4-D]pyrimidine
10g
$ 75.00

SynQuest Laboratories
3-Bromo-6-(methylsulfanyl)-1H-pyrazolo[3,4-d]pyrimidine 97.0%
250 mg
$ 290.00

SynQuest Laboratories
3-Bromo-6-(methylsulfanyl)-1H-pyrazolo[3,4-d]pyrimidine 97.0%
1 g
$ 790.00

Chemenu
3-bromo-6-(methylsulfanyl)-1H-pyrazolo[3,4-d]pyrimidine 95+%
1g
$ 621.00

Chemenu
3-bromo-6-(methylsulfanyl)-1H-pyrazolo[3,4-d]pyrimidine 95+%
5g
$ 1733.00

American Custom Chemicals Corporation
3-BROMO-6-(METHYLTHIO)-1H-PYRAZOLO[3,4-D]PYRIMIDINE 95.00%
5MG
$ 498.27

Ambeed
3-Bromo-6-(methylthio)-1H-pyrazolo[3,4-d]pyrimidine 95+%
5g
$ 567.00

Ambeed
3-Bromo-6-(methylthio)-1H-pyrazolo[3,4-d]pyrimidine 95+%
1g
$ 144.00

Ambeed
3-Bromo-6-(methylthio)-1H-pyrazolo[3,4-d]pyrimidine 95+%
250mg
$ 66.00

Ambeed
3-Bromo-6-(methylthio)-1H-pyrazolo[3,4-d]pyrimidine 95+%
100mg
$ 47.00

Total 23 raw suppliers

Chemical Property of 3-Bromo-6-(methylthio)-1H-pyrazolo[3,4-D]pyrimidine

Chemical Property:

PSA：79.76000
LogP:1.83730
Storage Temp.:under inert gas (nitrogen or Argon) at 2-8°C
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:243.94183
Heavy Atom Count:12
Complexity:170

Purity/Quality:

99%, ^*data from raw suppliers

3-Bromo-6-(methylthio)-1H-pyrazolo[3,4-D]pyrimidine ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CSC1=NC2=NNC(=C2C=N1)Br

Technology Process of 3-Bromo-6-(methylthio)-1H-pyrazolo[3,4-D]pyrimidine

There total 4 articles about 3-Bromo-6-(methylthio)-1H-pyrazolo[3,4-D]pyrimidine 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: 91.0%

: 100047-42-5
6-(methylsulfanyl)-1H,2H,3H-pyrazolo[3,4-d]pyrimidin-3-one

: 1306829-95-7
3-bromo-6-(methylsulfanyl)-1H-pyrazolo[3,4-d]pyrimidine

Guidance literature:: With phosphorus(V) oxybromide; at 110 ℃; for 3h; Temperature; Inert atmosphere;

Reference yield:

: 5909-24-0
4-chloro-2-methanesulfanylpyrimidine-5-carboxylic acid ethyl ester

: 1306829-95-7
3-bromo-6-(methylsulfanyl)-1H-pyrazolo[3,4-d]pyrimidine

Guidance literature:: Multi-step reaction with 2 steps

1: hydrazine / ethanol

2: phosphorus(V) oxybromide / acetonitrile / 16.5 h / 100 °C / Sonication

With hydrazine; phosphorus(V) oxybromide; In ethanol; acetonitrile;
DOI:10.1021/co200039k

Reference yield:

: 4-hydrazino-2-methylsulfanylpyrimidine-5-carboxylic acid methyl ester

: 1306829-95-7
3-bromo-6-(methylsulfanyl)-1H-pyrazolo[3,4-d]pyrimidine

Guidance literature:: Multi-step reaction with 2 steps

1.1: potassium hydroxide; acetic acid / water / 0.25 h / 0 °C / Reflux; Inert atmosphere

2.1: phosphorus(V) oxybromide / 8 h / 170 °C / Sealed tube; Inert atmosphere

2.2: 25 °C / Inert atmosphere

With acetic acid; potassium hydroxide; phosphorus(V) oxybromide; In water;