N-[5-Cyano-2-(hexylamino)pyrimidin-4-yl]benzamide

Base Information

Chemical Name:N-[5-Cyano-2-(hexylamino)pyrimidin-4-yl]benzamide
CAS No.:918662-97-2
Molecular Formula:C18H21N5O
Molecular Weight:323.398
Hs Code.:
DSSTox Substance ID:DTXSID00582154
Wikidata:Q82473487

Synonyms:918662-97-2;N-[5-Cyano-2-(hexylamino)pyrimidin-4-yl]benzamide;N-(5-Cyano-2-(hexylamino)pyrimidin-4-yl)benzamide;DTXSID00582154

Suppliers and Price of N-[5-Cyano-2-(hexylamino)pyrimidin-4-yl]benzamide

Supply Marketing:

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

Manufacturers and distributors:

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Chemical Property of N-[5-Cyano-2-(hexylamino)pyrimidin-4-yl]benzamide

Chemical Property:

XLogP3:4.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:8
Exact Mass:323.17461031
Heavy Atom Count:24
Complexity:426

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCCNC1=NC=C(C(=N1)NC(=O)C2=CC=CC=C2)C#N

Technology Process of N-[5-Cyano-2-(hexylamino)pyrimidin-4-yl]benzamide

There total 3 articles about N-[5-Cyano-2-(hexylamino)pyrimidin-4-yl]benzamide 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:

: 98-88-4
benzoyl chloride

: 91194-69-3
4-amino-2-hexylamino-pyrimidine-5-carbonitrile

: 918662-97-2
N-(5-cyano-2-hexylamino-pyrimidin-4-yl)-benzamide

Guidance literature:: With potassium tert-butylate; In N,N-dimethyl-formamide; at 0 - 20 ℃;
DOI:10.1080/00397910600773726

Reference yield:

: 770-30-9
4-amino-2-(methylthio)pyrimidine-5-carbonitrile

: 918662-97-2
N-(5-cyano-2-hexylamino-pyrimidin-4-yl)-benzamide

Guidance literature:: Multi-step reaction with 3 steps

1: m-chloroperbenzoic acid / tetrahydrofuran / 0 - 20 °C

2: tetrahydrofuran / Heating

3: t-BuOK / dimethylformamide / 0 - 20 °C

With potassium tert-butylate; 3-chloro-benzenecarboperoxoic acid; In tetrahydrofuran; N,N-dimethyl-formamide;
DOI:10.1080/00397910600773726

Reference yield:

: 98198-13-1
4-amino-2-methanesulfonyl-pyrimidine-5-carbonitrile

: 918662-97-2
N-(5-cyano-2-hexylamino-pyrimidin-4-yl)-benzamide

Guidance literature:: Multi-step reaction with 2 steps

1: tetrahydrofuran / Heating

2: t-BuOK / dimethylformamide / 0 - 20 °C

With potassium tert-butylate; In tetrahydrofuran; N,N-dimethyl-formamide;
DOI:10.1080/00397910600773726