Wx-uk1 free base

Base Information

Chemical Name:Wx-uk1 free base
CAS No.:220355-63-5
Molecular Formula:C32H47N5O5S
Molecular Weight:613.81100
Hs Code.:
UNII:00LOF6890B
Nikkaji Number:J1.195.698J
Wikidata:Q27089235
Pharos Ligand ID:5DKCQMCJP2XP
ChEMBL ID:CHEMBL107955
Mol file:220355-63-5.mol

Synonyms:N-alpha-(2,4,6-triisopropyl-phenylsulfonyl)-3-amidino-(L)-phenyl-alanine-4-ethoxycarbonyl-piperazide hydrochloride;WX-UK1

Suppliers and Price of Wx-uk1 free base

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

DC Chemicals
WX-UK1 >98%
50 mg
$ 1200.00

DC Chemicals
WX-UK1 >98%
10 mg
$ 400.00

Crysdot
UKI-1 98+%
1mg
$ 299.00

ChemScene
UKI-1 97.57%
100mg
$ 2520.00

ChemScene
UKI-1 97.57%
50mg
$ 1800.00

ChemScene
UKI-1 97.57%
10mg
$ 600.00

ChemScene
UKI-1 97.57%
5mg
$ 420.00

ChemScene
UKI-1 97.57%
1mg
$ 180.00

Total 2 raw suppliers

Chemical Property of Wx-uk1 free base

Chemical Property:

Boiling Point:745.5±70.0 °C(Predicted)
PKA:9.76±0.50(Predicted)
PSA：154.27000
Density:1.23±0.1 g/cm3(Predicted)
LogP:6.67870
XLogP3:4.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:12
Exact Mass:613.32979079
Heavy Atom Count:43
Complexity:1030

Purity/Quality:

97% ^*data from raw suppliers

WX-UK1 >98% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOC(=O)N1CCN(CC1)C(=O)C(CC2=CC(=CC=C2)C(=N)N)NS(=O)(=O)C3=C(C=C(C=C3C(C)C)C(C)C)C(C)C
Isomeric SMILES:CCOC(=O)N1CCN(CC1)C(=O)[C@H](CC2=CC(=CC=C2)C(=N)N)NS(=O)(=O)C3=C(C=C(C=C3C(C)C)C(C)C)C(C)C

Technology Process of Wx-uk1 free base

There total 19 articles about Wx-uk1 free base 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:

: 255374-80-2
Nα-2,4,6-Triisopropylphenylsulfonyl-(L)-3-cyano-phenylalanine

: 220355-63-5,255374-90-4
WX-UK₁

Guidance literature:: Multi-step reaction with 4 steps

1: hydroxylamine*HCl; diisopropylethylamine / ethanol / Heating

2: AcOH / 20 °C

3: PyBop; diisopropylethylamine / dimethylformamide / 0 - 20 °C

4: aq. AcOH; H₂ / Pd/C / 40 °C

With hydroxylamine hydrochloride; benzotriazol-1-yloxyl-tris-(pyrrolidino)-phosphonium hexafluorophosphate; hydrogen; acetic acid; N-ethyl-N,N-diisopropylamine; palladium on activated charcoal; In ethanol; N,N-dimethyl-formamide;
DOI:10.1021/jm051272l

Reference yield:

: C₃₄H₄₉N₅O₇S

: 220355-63-5,255374-90-4
WX-UK₁

Guidance literature:: With hydrogen; acetic acid; palladium;
DOI:10.1016/S0960-894X(99)00541-7

Reference yield:

: 797040-05-2
3-[3-(N-hydroxycarbamimidoyl)-phenyl]-2-(2,4,6-triisopropyl-benzenesulfonylamino)-propionic acid

: 220355-63-5,255374-90-4
WX-UK₁

Guidance literature:: Multi-step reaction with 3 steps

1: AcOH / 20 °C

2: PyBop; diisopropylethylamine / dimethylformamide / 0 - 20 °C

3: aq. AcOH; H₂ / Pd/C / 40 °C

With benzotriazol-1-yloxyl-tris-(pyrrolidino)-phosphonium hexafluorophosphate; hydrogen; acetic acid; N-ethyl-N,N-diisopropylamine; palladium on activated charcoal; In N,N-dimethyl-formamide;
DOI:10.1021/jm051272l