2-(3,5-Diamino-1-phenyl-1H-pyrazol-4-yl)-1-phenylethan-1-one

Base Information

Chemical Name:2-(3,5-Diamino-1-phenyl-1H-pyrazol-4-yl)-1-phenylethan-1-one
CAS No.:105576-68-9
Molecular Formula:C₁₇H₁₆N₄O
Molecular Weight:292.34
Hs Code.:
DSSTox Substance ID:DTXSID50543396
Wikidata:Q82420253

Synonyms:105576-68-9;2-(3,5-Diamino-1-phenyl-1H-pyrazol-4-yl)-1-phenylethanone;DTXSID50543396;2-(3,5-Diamino-1-phenyl-1H-pyrazol-4-yl)-1-phenylethan-1-one

Suppliers and Price of 2-(3,5-Diamino-1-phenyl-1H-pyrazol-4-yl)-1-phenylethan-1-one

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 2-(3,5-Diamino-1-phenyl-1H-pyrazol-4-yl)-1-phenylethan-1-one

Chemical Property:

XLogP3:2.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:292.13241115
Heavy Atom Count:22
Complexity:377

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)C(=O)CC2=C(N(N=C2N)C3=CC=CC=C3)N

Technology Process of 2-(3,5-Diamino-1-phenyl-1H-pyrazol-4-yl)-1-phenylethan-1-one

There total 2 articles about 2-(3,5-Diamino-1-phenyl-1H-pyrazol-4-yl)-1-phenylethan-1-one 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: 53.0%

: 14476-72-3
2-(2-oxo-2-phenylethyl)malononitrile

: 100-63-0
phenylhydrazine

: 105576-68-9
3,5-Diamino-4-phenacyl-1-phenylpyrazole

Guidance literature:: With triethylamine; In ethanol; for 2h; Heating;
DOI:10.1055/s-1986-31484

Reference yield:

: 70-11-1
α-bromoacetophenone

: 105576-68-9
3,5-Diamino-4-phenacyl-1-phenylpyrazole

Guidance literature:: Multi-step reaction with 2 steps

1: 40 percent / piperidine / 1 h / Heating

2: 53 percent / triethylamine / ethanol / 2 h / Heating

With piperidine; triethylamine; In ethanol;
DOI:10.1055/s-1986-31484