5-(4-chlorophenyl)-1-(4-methoxyphenyl)-3-(trifluoromethyl)-1H-pyrazole

Base Information

Chemical Name:5-(4-chlorophenyl)-1-(4-methoxyphenyl)-3-(trifluoromethyl)-1H-pyrazole
CAS No.:188817-13-2
Molecular Formula:C17H12ClF3N2O
Molecular Weight:352.743
Hs Code.:2933199090
European Community (EC) Number:633-769-1
ChEMBL ID:CHEMBL26915
DSSTox Substance ID:DTXSID00401775
Metabolomics Workbench ID:129949
Nikkaji Number:J1.322.077H
Pharos Ligand ID:7N42X347KY2V
Wikidata:Q27145845
Mol file:188817-13-2.mol

Synonyms:5-(4-chlorophenyl)-1-(4-methoxyphenyl)-3-trifluoromethylpyrazole;SC 560;SC-560;SC560

Suppliers and Price of 5-(4-chlorophenyl)-1-(4-methoxyphenyl)-3-(trifluoromethyl)-1H-pyrazole

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

Usbiological
SC 560
100mg
$ 1677.00

Usbiological
SC 560
10mg
$ 423.00

TRC
5-(4-Chlorophenyl)-1-(4-methoxyphenyl)-3-(trifluoromethyl)-1H-pyrazole
100mg
$ 495.00

Tocris
SC-560 ≥98%(HPLC)
10
$ 179.00

TCI Chemical
SC-560
25MG
$ 61.00

TCI Chemical
SC-560
100MG
$ 210.00

Sigma-Aldrich
SC-560
5mg
$ 140.60

Sigma-Aldrich
SC-560 ≥98% (HPLC)
5mg
$ 207.00

DC Chemicals
SC-560 >98%
100 mg
$ 400.00

DC Chemicals
SC-560 >98%
250 mg
$ 800.00

Total 30 raw suppliers

Chemical Property of 5-(4-chlorophenyl)-1-(4-methoxyphenyl)-3-(trifluoromethyl)-1H-pyrazole

Chemical Property:

Vapor Pressure:1.51E-07mmHg at 25°C
Melting Point:63 °C
Refractive Index:1.563
Boiling Point:440.6 °C at 760 mmHg
PKA:-3?+-.0.10(Predicted)
Flash Point:220.3 °C
PSA：27.05000
Density:1.33 g/cm³
LogP:5.22010
Storage Temp.:2-8°C
Solubility.:DMSO: >20mg/mL
XLogP3:5.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:352.0590252
Heavy Atom Count:24
Complexity:407

Purity/Quality:

97% ^*data from raw suppliers

SC 560 ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:COC1=CC=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C3=CC=C(C=C3)Cl
Uses 5-(4-Chlorophenyl)-1-(4-methoxyphenyl)-3-(trifluoromethyl)-1H-pyrazole is used as a cyclooxygenase inhibitors on the angiogenesis and apoptosis. SC-560 has been used as a cyclooxygenase-1 (COX-1) inhibitor to study its effects on prostaglandin E-2 (PGE2) signaling in ciliogenesis in zebrafish embryos. It has also been used as a selective inhibitor of COX-1 to study its role in PM10-induced endothelial dysfunction.

Technology Process of 5-(4-chlorophenyl)-1-(4-methoxyphenyl)-3-(trifluoromethyl)-1H-pyrazole

There total 11 articles about 5-(4-chlorophenyl)-1-(4-methoxyphenyl)-3-(trifluoromethyl)-1H-pyrazole 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: 96.0%

: 19501-58-7
4-methoxyphenylhydrazine hydrochloride

: 18931-60-7
1-(4-chlorophenyl)-4,4,4-trifluorobutane-1,3-dione

: 188817-13-2
SC-560

Guidance literature:: In ethanol; for 18h; Reflux;
DOI:10.1021/acs.orglett.9b00025

Reference yield: 93.0%

: 77063-21-9
4-(4-chlorophenyl)-1,1,1-trifluorobut-3-yn-2-one

: 3471-32-7
4-Methoxyphenylhydrazine

: 188817-13-2
SC-560

Guidance literature:: With silver trifluoromethanesulfonate; In chloroform; at 20 ℃; for 1h; regioselective reaction; Sealed tube;
DOI:10.1002/ejoc.201800208