4-[(E)-2-(1H-Indol-3-YL)-vinyl]-1-methyl-pyridinium; iodide

Base Information

Chemical Name:4-[(E)-2-(1H-Indol-3-YL)-vinyl]-1-methyl-pyridinium; iodide
CAS No.:36098-33-6
Molecular Formula:C₁₆H₁₅N₂*I
Molecular Weight:362.213
Hs Code.:
European Community (EC) Number:668-548-9
NSC Number:158021
ChEMBL ID:CHEMBL1485211
Mol file:36098-33-6.mol

Synonyms:F16;36098-33-6;4-[(E)-2-(1H-INDOL-3-YL)-VINYL]-1-METHYL-PYRIDINIUM;IODIDE;26608-75-3;3-[(E)-2-(1-methylpyridin-1-ium-4-yl)ethenyl]-1H-indole;iodide;(E)-4-(3-indolylvinyl)-N-methylpyridinium iodide;4-[(E)-2-(1H-Indol-3-yl)-vinyl]-1-methyl-pyridinium;4-[(E)-2-(Indol-3-yl)ethenyl]-N-methylpyridinium iodide;SMR000178707;MLS000557147;CHEMBL1485211;SCHEMBL17270524;HMS2542C03;HMS3648A09;NSC158021;AKOS027469358;CS-5707;NSC-158021;MS-25743;HY-100395;F85403;SR-01000485413-3;(e)-4-(1h-indol-3-ylvinyl)-N-methylpyridinium iodide

Suppliers and Price of 4-[(E)-2-(1H-Indol-3-YL)-vinyl]-1-methyl-pyridinium; iodide

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

TRC
F16
25mg
$ 95.00

DC Chemicals
F16 >98%
50 mg
$ 144.00

Crysdot
F16 98+%
50mg
$ 132.00

Crysdot
F16 98+%
25mg
$ 76.00

Cayman Chemical
F16 ≥98%
10mg
$ 72.00

Cayman Chemical
F16 ≥98%
5mg
$ 41.00

Cayman Chemical
F16 ≥98%
1mg
$ 9.00

Cayman Chemical
F16 ≥98%
50mg
$ 315.00

Biorbyt Ltd
F16
50 mg
$ 382.50

Biorbyt Ltd
F16
25 mg
$ 229.50

Total 14 raw suppliers

Chemical Property of 4-[(E)-2-(1H-Indol-3-YL)-vinyl]-1-methyl-pyridinium; iodide

Chemical Property:

PSA：19.67000
LogP:0.16680
Solubility.:≤500μg/ml in ethanol;20mg/ml in DMSO;25mg/ml in dimethyl formamide
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:362.02800
Heavy Atom Count:19
Complexity:292

Purity/Quality:

97% ^*data from raw suppliers

F16 ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C[N+]1=CC=C(C=C1)C=CC2=CNC3=CC=CC=C32.[I-]
Isomeric SMILES:C[N+]1=CC=C(C=C1)/C=C/C2=CNC3=CC=CC=C32.[I-]
Uses F16 is a cell-permeable mitochondrial toxin with apoptotic and necrotic action in tumor cell lines.

Technology Process of 4-[(E)-2-(1H-Indol-3-YL)-vinyl]-1-methyl-pyridinium; iodide

There total 6 articles about 4-[(E)-2-(1H-Indol-3-YL)-vinyl]-1-methyl-pyridinium; iodide 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: 51.7%

: C₁₅H₁₂N₂

: 74-88-4
methyl iodide

: 26608-75-3,36098-33-6,465537-64-8
4-[(E)-2-(1H-Indol-3-yl)-vinyl]-1-methyl-pyridinium; iodide

Guidance literature:: In N,N-dimethyl-formamide; at 20 ℃;
DOI:10.1016/j.ejmech.2018.05.036

Reference yield:

: 487-89-8,1228547-52-1
Indole-3-carboxaldehyde

: 26608-75-3,36098-33-6,465537-64-8
4-[(E)-2-(1H-Indol-3-yl)-vinyl]-1-methyl-pyridinium; iodide

Guidance literature:: Multi-step reaction with 2 steps

1: pyrrolidine / ethanol; ethane-1,2-diol

2: ethanol; ethane-1,2-diol / 0.05 h / microwave irradiation

pyrrolidine; In ethanol; ethylene glycol;
DOI:10.1021/ja027587x

Reference yield:

: 2301-80-6
N-methyl-4-methylpyridinium iodide

: 26608-75-3,36098-33-6,465537-64-8
4-[(E)-2-(1H-Indol-3-yl)-vinyl]-1-methyl-pyridinium; iodide

Guidance literature:: Multi-step reaction with 2 steps

1: pyrrolidine / ethanol; ethane-1,2-diol

2: ethanol; ethane-1,2-diol / 0.05 h / microwave irradiation

pyrrolidine; In ethanol; ethylene glycol;
DOI:10.1021/ja027587x