6-(Methylthio)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Base Information

Chemical Name:6-(Methylthio)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
CAS No.:5444-29-1
Molecular Formula:C6H7 N5 S
Molecular Weight:181.221
Hs Code.:2933990090
NSC Number:19067
DSSTox Substance ID:DTXSID30280914
Wikidata:Q82014590
ChEMBL ID:CHEMBL1905829
Mol file:5444-29-1.mol

Synonyms:5444-29-1;6-(Methylthio)-1H-pyrazolo[3,4-d]pyrimidin-4-amine;MLS002638653;6-methylsulfanyl-1H-pyrazolo[3,4-d]pyrimidin-4-amine;NSC19067;SCHEMBL446779;CHEMBL1905829;DTXSID30280914;HMS3095K08;NSC 19067;NSC-19067;AKOS006344572;SMR001548123;4-amino-6-methylmercaptopyrazolo[3,4-d]pyrimidine;4-Amino-2-(methylmercapto)-7H-pyrazole[2,3-d]pyrimidine, AldrichCPR

Suppliers and Price of 6-(Methylthio)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

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

Sigma-Aldrich
4-Amino-2-(methylmercapto)-7H-pyrazole[2,3-d]pyrimidine Aldrich
1g
$ 277.00

Crysdot
6-(Methylthio)-1H-pyrazolo[3,4-d]pyrimidin-4-amine 95+%
1g
$ 518.00

Chemenu
6-(Methylthio)-1H-pyrazolo[3,4-d]pyrimidin-4-amine 95%
1g
$ 489.00

AK Scientific
6-(Methylthio)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
1g
$ 411.00

Total 7 raw suppliers

Chemical Property of 6-(Methylthio)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Chemical Property:

Vapor Pressure:3.52E-11mmHg at 25°C
Boiling Point:526.6°C at 760 mmHg
Flash Point:272.3°C
PSA：105.78000
Density:1.55g/cm³
LogP:1.23820
XLogP3:0.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:181.04221642
Heavy Atom Count:12
Complexity:166

Purity/Quality:

99% ^*data from raw suppliers

4-Amino-2-(methylmercapto)-7H-pyrazole[2,3-d]pyrimidine Aldrich ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xn
Statements: 22

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CSC1=NC(=C2C=NNC2=N1)N

Technology Process of 6-(Methylthio)-1H-pyrazolo[3,4-d]pyrimidin-4-amine

There total 4 articles about 6-(Methylthio)-1H-pyrazolo[3,4-d]pyrimidin-4-amine 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:

: 85426-79-5
4-chloro-6-methylmercapto-1H-pyrazolo[3,4-d]pyrimidine

: 5444-29-1
6-methylsulfanyl-1⁽²⁾H-pyrazolo[3,4-d]pyrimidin-4-ylamine

Guidance literature:: With ammonia; water; at 100 ℃;
DOI:10.1021/ja01585a023

Reference yield:

: 6288-85-3
6-chloro-4-methylsulfanyl-1⁽²⁾H-pyrazolo[3,4-d]pyrimidine

: 5444-29-1
6-methylsulfanyl-1⁽²⁾H-pyrazolo[3,4-d]pyrimidin-4-ylamine

Guidance literature:: With ammonia; water; at 100 ℃;

Reference yield:

: 24521-76-4
6-thioxo-1,5,6,7-tetrahydropyrazolo<3,4-d>pyrimidin-4-one

: 5444-29-1
6-methylsulfanyl-1⁽²⁾H-pyrazolo[3,4-d]pyrimidin-4-ylamine

Guidance literature:: Multi-step reaction with 3 steps

1: aq. NaOH solution

2: N,N-dimethyl-aniline; POCl₃

3: H₂O; NH₃ / 100 °C

With sodium hydroxide; ammonia; water; N,N-dimethyl-aniline; trichlorophosphate;
DOI:10.1021/ja01585a023