p38 MAP Kinase Inhibitor III

Base Information

Chemical Name:p38 MAP Kinase Inhibitor III
CAS No.:549505-65-9
Molecular Formula:C23H21FN4S
Molecular Weight:404.50300
Hs Code.:
UNII:VW1528F5YP
DSSTox Substance ID:DTXSID301336897
Nikkaji Number:J3.498.913C
Wikidata:Q27088230
ChEMBL ID:CHEMBL111364
Mol file:549505-65-9.mol

Synonyms:(4-(5-(4-fluorophenyl)-2-methylsulfanyl-3H-imidazol-4-yl)pyridin-2-yl)-(1-phenylethyl)amine;ML 3403;ML-3403;ML3403

Suppliers and Price of p38 MAP Kinase Inhibitor III

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
ML 3403
10mg
$ 480.00

TRC
ML3403
10mg
$ 145.00

Tocris
ML3403 ≥98%(HPLC)
10
$ 195.00

Tocris
ML3403 ≥98%(HPLC)
50
$ 803.00

Medical Isotopes, Inc.
ML3403
10 mg
$ 640.00

Matrix Scientific
4-(4-(4-Fluorophenyl)-2-(methylthio)-1H-imidazol-5-yl)-N-(1-phenylethyl)pyridin-2-amine 95%
10mg
$ 833.00

American Custom Chemicals Corporation
P-38 MAP KINASE INHIBITOR(III) 95.00%
5MG
$ 499.03

Total 3 raw suppliers

Chemical Property of p38 MAP Kinase Inhibitor III

Chemical Property:

PSA：78.90000
LogP:6.24580
XLogP3:5.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:404.14709602
Heavy Atom Count:29
Complexity:495

Purity/Quality:

98% ^*data from raw suppliers

ML 3403 ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC(C1=CC=CC=C1)NC2=NC=CC(=C2)C3=C(NC(=N3)SC)C4=CC=C(C=C4)F
Uses ML 3403 is a potent and selective p38 mitogen-activated protein kinase (MAPK) inhibitor. MAPK is a key mediator in cytokine-induced signaling events and plays an integral role in disease states including oncogenesis, autoimmune diseases, and inflammatory processes. Therefore, MAPK inhibitors such as ML 3403 provides an attractive strategy for therapeutic intervention.

Technology Process of p38 MAP Kinase Inhibitor III

There total 7 articles about p38 MAP Kinase Inhibitor III 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: 41.0%

: 618-36-0
rac-methylbenzylamine

: 549505-59-1
2-fluoro-4-[5-(4-fluorophenyl)-2-methylsulfanyl-3H-imidazol-4-yl]pyridine

: 549505-65-9
ML 3403

Guidance literature:: at 160 ℃; for 7h;
DOI:10.1021/jm030766k

Reference yield:

: 461-87-0
2-fluoro-4-methylpyridine

: 549505-65-9
ML 3403

Guidance literature:: Multi-step reaction with 6 steps

1.1: LDA / tetrahydrofuran; hexane / -85 °C

1.2: 99 percent / tetrahydrofuran; hexane / -85 - 0 °C

2.1: 86 percent / aq. NaNO₂; AcOH / 10 - 20 °C

3.1: H₂; HCl / Pd/C / propan-2-ol / 20 °C / atmospheric pressure

4.1: 91 percent / dimethylformamide / Heating

5.1: 30 percent / ethanol; tetrahydrofuran / 40 h / Heating

6.1: 41 percent / 7 h / 160 °C

With hydrogenchloride; hydrogen; acetic acid; lithium diisopropyl amide; sodium nitrite; palladium on activated charcoal; In tetrahydrofuran; ethanol; hexane; N,N-dimethyl-formamide; isopropyl alcohol;
DOI:10.1021/jm030766k

Reference yield:

: 116332-54-8
4-fluoro-N-methoxy-N-methylbenzamide

: 549505-65-9
ML 3403

Guidance literature:: Multi-step reaction with 6 steps

1.1: LDA / tetrahydrofuran; hexane / -85 °C

1.2: 99 percent / tetrahydrofuran; hexane / -85 - 0 °C

2.1: 86 percent / aq. NaNO₂; AcOH / 10 - 20 °C

3.1: H₂; HCl / Pd/C / propan-2-ol / 20 °C / atmospheric pressure

4.1: 91 percent / dimethylformamide / Heating

5.1: 30 percent / ethanol; tetrahydrofuran / 40 h / Heating

6.1: 41 percent / 7 h / 160 °C

With hydrogenchloride; hydrogen; acetic acid; lithium diisopropyl amide; sodium nitrite; palladium on activated charcoal; In tetrahydrofuran; ethanol; hexane; N,N-dimethyl-formamide; isopropyl alcohol;
DOI:10.1021/jm030766k