N-(2-chloropyrimidin-5-yl)-3-fluorobenzamide

Base Information

Chemical Name:N-(2-chloropyrimidin-5-yl)-3-fluorobenzamide
CAS No.:582323-10-2
Molecular Formula:C₁₁H₇ClFN₃O
Molecular Weight:251.647
Hs Code.:
DSSTox Substance ID:DTXSID60437050
Wikidata:Q82252407
ChEMBL ID:CHEMBL2047520

Synonyms:N-(2-chloropyrimidin-5-yl)-3-fluorobenzamide;582323-10-2;CHEMBL2047520;SCHEMBL5346150;DTXSID60437050;BDBM50420086

Suppliers and Price of N-(2-chloropyrimidin-5-yl)-3-fluorobenzamide

Supply Marketing:

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

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Chemical Property of N-(2-chloropyrimidin-5-yl)-3-fluorobenzamide

Chemical Property:

XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:251.0261677
Heavy Atom Count:17
Complexity:271

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC(=C1)F)C(=O)NC2=CN=C(N=C2)Cl

Technology Process of N-(2-chloropyrimidin-5-yl)-3-fluorobenzamide

There total 2 articles about N-(2-chloropyrimidin-5-yl)-3-fluorobenzamide 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:

: 56621-90-0
2-chloro-5-aminopyrimidine

: 1711-07-5
3-fluorobenzoyl chloride

: 582323-10-2
N-(2-chloropyrimidin-5-yl)-3-fluorobenzamide

Guidance literature:: With pyridine; In tetrahydrofuran; at 20 ℃; for 1h;
DOI:10.1021/ml200053x

Reference yield:

: 455-38-9
3-fluorobenzoic acid

: 582323-10-2
N-(2-chloropyrimidin-5-yl)-3-fluorobenzamide

Guidance literature:: Multi-step reaction with 2 steps

1: oxalyl dichloride; N,N-dimethyl-formamide / dichloromethane / 0 - 20 °C

2: pyridine / tetrahydrofuran / 1 h / 20 °C

With pyridine; oxalyl dichloride; N,N-dimethyl-formamide; In tetrahydrofuran; dichloromethane;
DOI:10.1021/ml200053x