(R)-4-(2-(2-(2-methylpyrrolidin-1-yl)ethyl)benzofuran-5-yl)benzonitrile

Base Information

Chemical Name:(R)-4-(2-(2-(2-methylpyrrolidin-1-yl)ethyl)benzofuran-5-yl)benzonitrile
CAS No.:460746-46-7
Molecular Formula:C22H22N2O
Molecular Weight:330.429
Hs Code.:2934999090
UNII:86H6B395PI
DSSTox Substance ID:DTXSID00196710
Nikkaji Number:J2.053.309I
Wikipedia:ABT-239
Wikidata:Q4650421
Pharos Ligand ID:SUQM9JGTPG47
ChEMBL ID:CHEMBL351231
Mol file:460746-46-7.mol

Synonyms:(R)-4-(2-(2-(2-methyl-1-pyrrolidinyl)ethyl)-1-benzofuran-5-yl)benzonitrile;4-(2-(2-(2-methyl-1-pyrrolidinyl)ethyl)-1-benzofuran-5-yl)benzonitrile;ABT 239;ABT-239;ABT239;benzonitrile, 4-(2-(2-((2r)-2-methyl-1-pyrrolidinyl)ethyl)-5-benzofuranyl)-

Suppliers and Price of (R)-4-(2-(2-(2-methylpyrrolidin-1-yl)ethyl)benzofuran-5-yl)benzonitrile

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

Matrix Scientific
(R)-4-(2-(2-(2-Methylpyrrolidin-1-yl)-ethyl)benzofuran-5-yl)benzonitrile 95+%
250mg
$ 756.00

Matrix Scientific
(R)-4-(2-(2-(2-Methylpyrrolidin-1-yl)-ethyl)benzofuran-5-yl)benzonitrile 95+%
1g
$ 1647.00

DC Chemicals
ABT-239 >98%
100 mg
$ 500.00

DC Chemicals
ABT-239 >98%
1 g
$ 2000.00

Crysdot
ABT-239 95+%
50mg
$ 686.00

Crysdot
ABT-239 95+%
5mg
$ 111.00

Crysdot
ABT-239 95+%
25mg
$ 381.00

Crysdot
ABT-239 95+%
10mg
$ 180.00

ChemScene
ABT-239 99.06%
5mg
$ 150.00

ChemScene
ABT-239 99.06%
10mg
$ 250.00

Total 32 raw suppliers

Chemical Property of (R)-4-(2-(2-(2-methylpyrrolidin-1-yl)ethyl)benzofuran-5-yl)benzonitrile

Chemical Property:

Boiling Point:493.5±40.0 °C(Predicted)
PKA:10.13±0.40(Predicted)
PSA：40.17000
Density:1.18±0.1 g/cm3(Predicted)
LogP:4.93618
Storage Temp.:2-8°C
XLogP3:4.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:330.173213330
Heavy Atom Count:25
Complexity:490

Purity/Quality:

97% ^*data from raw suppliers

(R)-4-(2-(2-(2-Methylpyrrolidin-1-yl)-ethyl)benzofuran-5-yl)benzonitrile 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1CCCN1CCC2=CC3=C(O2)C=CC(=C3)C4=CC=C(C=C4)C#N
Isomeric SMILES:C[C@@H]1CCCN1CCC2=CC3=C(O2)C=CC(=C3)C4=CC=C(C=C4)C#N

Technology Process of (R)-4-(2-(2-(2-methylpyrrolidin-1-yl)ethyl)benzofuran-5-yl)benzonitrile

There total 16 articles about (R)-4-(2-(2-(2-methylpyrrolidin-1-yl)ethyl)benzofuran-5-yl)benzonitrile 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: 72.0%

: 670342-24-2
toluene-4-sulfonic acid 2-[5-(4-cyano-phenyl)benzofuran-2-yl]ethyl ester

: (2R)-2-methylpyrrolidine L-(+)-tartrate

: C₁₇H₁₁NO

: 460746-46-7
4-{2-[2-(2R-methylpyrrolidin-1-yl)ethyl]benzofuran-5-yl}benzonitrile

Guidance literature:: (2R)-2-methylpyrrolidine L-(+)-tartrate; With potassium carbonate; In acetonitrile; at 60 ℃; for 48h; Inert atmosphere; Large scale;

toluene-4-sulfonic acid 2-[5-(4-cyano-phenyl)benzofuran-2-yl]ethyl ester; In acetonitrile; at 25 - 60 ℃; for 36h; Inert atmosphere; Large scale;
DOI:10.1021/op049809c