(S,E)-3-(6-bromopyridin-2-yl)-2-cyano-N-(1-phenylbutyl)acrylamide

Base Information

Chemical Name:(S,E)-3-(6-bromopyridin-2-yl)-2-cyano-N-(1-phenylbutyl)acrylamide
CAS No.:856243-80-6
Molecular Formula:C19 H18 BrN3 O
Molecular Weight:384.275
Hs Code.:
DSSTox Substance ID:DTXSID50459281
Nikkaji Number:J3.264.508I
Wikidata:Q72516581
ChEMBL ID:CHEMBL1923233
Mol file:856243-80-6.mol

Synonyms:2-cyano-N-(1-phenylbutyl)-3-(6-bromopyridin-2-yl)acrylamide;degrasyn;WP1130

Suppliers and Price of (S,E)-3-(6-bromopyridin-2-yl)-2-cyano-N-(1-phenylbutyl)acrylamide

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
WP1130
5mg
$ 262.00

TRC
(2E)-3-(6-Bromo-2-pyridinyl)-2-cyano-N-[(1S)-1-phenylbutyl]-2-propenamide
5mg
$ 70.00

DC Chemicals
WP1130(Degrasyn) >98%
1 g
$ 1900.00

DC Chemicals
WP1130(Degrasyn) >98%
100 mg
$ 550.00

Crysdot
WP1130 98+%
50mg
$ 500.00

Crysdot
WP1130 98+%
100mg
$ 708.00

Crysdot
WP1130 98+%
5mg
$ 88.00

Crysdot
WP1130 98+%
10mg
$ 165.00

ChemScene
Degrasyn 99.70%
10mg
$ 126.00

ChemScene
Degrasyn 99.70%
5mg
$ 72.00

Total 20 raw suppliers

Chemical Property of (S,E)-3-(6-bromopyridin-2-yl)-2-cyano-N-(1-phenylbutyl)acrylamide

Chemical Property:

PSA：69.27000
Density:1.358
LogP:5.24898
Storage Temp.:-20°
Solubility.:Soluble in DMSO (up to 45 mg/ml), or in Ethanol (up to 25 mg/ml).
XLogP3:4.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:383.06332
Heavy Atom Count:24
Complexity:490

Purity/Quality:

99%, ^*data from raw suppliers

WP1130 ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCC(C1=CC=CC=C1)NC(=O)C(=CC2=NC(=CC=C2)Br)C#N
Isomeric SMILES:CCC[C@@H](C1=CC=CC=C1)NC(=O)/C(=C/C2=NC(=CC=C2)Br)/C#N
Description WP1130 (856243-80-6) is a novel DUB inhibitor directly inhibiting USP9x, USP5, USP14 and UCH37 inducing rapid accumulation of polyubiquitinated proteins. Triggers tumor cell apoptosis.1 Blocks Jak2 signaling via Jak2 ubiquitination.2 WP-1130 causes ablation of the oncogenic transcription factor ERG in prostate cancer cells.3 See methyl analog WP1066.

Technology Process of (S,E)-3-(6-bromopyridin-2-yl)-2-cyano-N-(1-phenylbutyl)acrylamide

There total 2 articles about (S,E)-3-(6-bromopyridin-2-yl)-2-cyano-N-(1-phenylbutyl)acrylamide 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: 65.0%

: 34160-40-2
6-bromo-2-pyridinecarbaldehyde

: 1240038-58-7
(S)-2-cyano-N-(1-phenylbutyl)acetamide

: 856243-80-6
WP 1130

Guidance literature:: With piperidine; In ethanol; for 3h; Reflux;
DOI:10.1039/c9cc09204h

Reference yield:

: 3789-60-4
(S)-1-amino-1-phenylbutane

: 856243-80-6
WP 1130

Guidance literature:: Multi-step reaction with 2 steps

1: toluene / 2 h / Reflux

2: piperidine / ethanol / 3 h / Reflux

With piperidine; In ethanol; toluene;
DOI:10.1039/c9cc09204h