6-chloro-N-(2,3-dimethylphenyl)-2-(methylthio)pyrimidin-4-amine

Base Information

Chemical Name:6-chloro-N-(2,3-dimethylphenyl)-2-(methylthio)pyrimidin-4-amine
CAS No.:86626-95-1
Molecular Formula:C13H14ClN3S
Molecular Weight:279.793
Hs Code.:
ChEMBL ID:CHEMBL298255
DSSTox Substance ID:DTXSID10540048
Wikidata:Q82415915

Synonyms:86626-95-1;6-chloro-N-(2,3-dimethylphenyl)-2-(methylthio)pyrimidin-4-amine;CHEMBL298255;SCHEMBL10997716;DTXSID10540048;AKOS019110268;6-Chloro-N-(2,3-dimethylphenyl)-2-(methylsulfanyl)pyrimidin-4-amine

Suppliers and Price of 6-chloro-N-(2,3-dimethylphenyl)-2-(methylthio)pyrimidin-4-amine

Supply Marketing:

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

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Chemical Property of 6-chloro-N-(2,3-dimethylphenyl)-2-(methylthio)pyrimidin-4-amine

Chemical Property:

XLogP3:4.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:279.0596963
Heavy Atom Count:18
Complexity:267

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C(=CC=C1)NC2=CC(=NC(=N2)SC)Cl)C

Technology Process of 6-chloro-N-(2,3-dimethylphenyl)-2-(methylthio)pyrimidin-4-amine

There total 3 articles about 6-chloro-N-(2,3-dimethylphenyl)-2-(methylthio)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: 48.0%

: 6299-25-8
4,6-Dichloro-2-(methylthio)pyrimidine

: 87-59-2
2,3-Dimethylaniline

: 86626-95-1
6-chloro-N-(2,3-dimethylphenyl)-2-(methylsulfanyl)pyrimidin-4-amine

Guidance literature:: With triethylamine; In ethanol; at 120 ℃; for 4h; Microwave irradiation;
DOI:10.1021/acs.jmedchem.8b01848

Reference yield:

: 6299-25-8
4,6-Dichloro-2-(methylthio)pyrimidine

: 497-19-8
sodium carbonate

: 87-59-2
2,3-Dimethylaniline

: 86626-95-1
6-chloro-N-(2,3-dimethylphenyl)-2-(methylsulfanyl)pyrimidin-4-amine

Guidance literature:: In ethanol;

Reference yield:

: 1979-98-2
4,6-dihydroxy-2-methylmercaptopyrimidine

: 86626-95-1
6-chloro-N-(2,3-dimethylphenyl)-2-(methylsulfanyl)pyrimidin-4-amine

Guidance literature:: Multi-step reaction with 2 steps

1: 70 percent / POCl₃, N,N-diethylaniline / 2 h / Heating

2: 45 percent / Na₂CO₃ / acetonitrile / 18 h / Heating

With sodium carbonate; N,N-diethylaniline; trichlorophosphate; In acetonitrile;
DOI:10.1021/jm00378a016