4-[3-(4-Methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]benzoic acid

Base Information

Chemical Name:4-[3-(4-Methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]benzoic acid
CAS No.:10180-08-2
Molecular Formula:C₂₃H₂₀N₂O₃
Molecular Weight:372.423
Hs Code.:
European Community (EC) Number:683-030-2
ChEMBL ID:CHEMBL3979746

Synonyms:KUC103375N;UNM-0000306085;4-[3-(4-methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]benzoic acid;CHEMBL3979746;SCHEMBL12493661;BDBM54632;cid_5181298;AKOS005154041;10180-08-2;US9388139, 7;4-[5-(4-methoxyphenyl)-3-phenyl-2-pyrazolin-1-yl]benzoic acid;4-(5-(4-Methoxyphenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid;4-(5-(4-METHOXY-PHENYL)-3-PHENYL-4,5-DIHYDRO-PYRAZOL-1-YL)-BENZOIC ACID

Suppliers and Price of 4-[3-(4-Methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]benzoic acid

Supply Marketing:

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

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Chemical Property of 4-[3-(4-Methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]benzoic acid

Chemical Property:

XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:372.14739250
Heavy Atom Count:28
Complexity:556

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC1=CC=C(C=C1)C2CC(=NN2C3=CC=C(C=C3)C(=O)O)C4=CC=CC=C4

Technology Process of 4-[3-(4-Methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]benzoic acid

There total 3 articles about 4-[3-(4-Methoxyphenyl)-5-phenyl-3,4-dihydropyrazol-2-yl]benzoic acid 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: 60.0%

: 22252-15-9
trans-4-methoxychalcone

: 24589-77-3,52455-33-1
4-hydrazinobenzoic acid hydrochloride

: 10180-08-2
4-(5-(4-methoxyphenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid

Guidance literature:: In N,N-dimethyl-formamide; at 85 ℃; for 5h; regioselective reaction;
DOI:10.1021/acs.jmedchem.0c01120

Reference yield: 60.0%

: 10180-08-2
4-(5-(4-methoxyphenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid

Guidance literature:

Reference yield:

: 123-11-5
4-methoxy-benzaldehyde

: 10180-08-2
4-(5-(4-methoxyphenyl)-3-phenyl-4,5-dihydro-1H-pyrazol-1-yl)benzoic acid

Guidance literature:: Multi-step reaction with 2 steps

1: potassium hydroxide / methanol / 20 °C / Cooling with ice

2: N,N-dimethyl-formamide / 5 h / 85 °C

With potassium hydroxide; In methanol; N,N-dimethyl-formamide; 1: |Claisen-Schmidt Condensation;
DOI:10.1021/acs.jmedchem.0c01120