KPI-10 free base

Base Information

Chemical Name:KPI-10 free base
CAS No.:888032-58-4
Molecular Formula:C₂₂H₂₂F₃N₅O₃
Molecular Weight:461.444
Hs Code.:
UNII:RTQ8P0159M
ChEMBL ID:CHEMBL3633522
Wikidata:Q27288286

Synonyms:1-(6-amino-3,5-difluoropyridin-2-yl)-6-fluoro-7-(3-(isopropylamino)azetidin-1-yl)-8-methyl-4-oxo-1,4-dihydroquinoline-3-carboxylic acid;WQ-3810

Suppliers and Price of KPI-10 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

Crysdot
1-(6-Amino-3,5-difluoropyridin-2-yl)-6-fluoro-7-(3-(isopropylamino)azetidin-1-yl)-8-methyl-4-oxo-1,4-dihydroquinoline-3-carboxylicacid 97%
100mg
$ 668.00

Total 3 raw suppliers

Chemical Property of KPI-10 free base

Chemical Property:

XLogP3:1.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:5
Exact Mass:461.16747407
Heavy Atom Count:33
Complexity:808

Purity/Quality:

95% ^*data from raw suppliers

1-(6-Amino-3,5-difluoropyridin-2-yl)-6-fluoro-7-(3-(isopropylamino)azetidin-1-yl)-8-methyl-4-oxo-1,4-dihydroquinoline-3-carboxylicacid 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=C2C(=CC(=C1N3CC(C3)NC(C)C)F)C(=O)C(=CN2C4=C(C=C(C(=N4)N)F)F)C(=O)O

Technology Process of KPI-10 free base

There total 9 articles about KPI-10 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: 52.0%

: 189280-68-0
1-(6-amino-3,5-difluoropyridin-2-yl)-6,7-difluoro-8-methyl-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

: 888032-75-5
3-(isopropylamino)azetidine hydrochloride

: 888032-58-4
WQ-3810

Guidance literature:: With lithium hydroxide monohydrate; lithium chloride; N,N,N',N'-tetramethylguanidine; In dimethyl sulfoxide; at 30 - 35 ℃; for 40h;
DOI:10.1016/j.ejmech.2015.08.015

Reference yield:

: 2-benzylamino-6-(tert-butylamino)-3,5-difluoropyridine

: 888032-58-4
WQ-3810

Guidance literature:: Multi-step reaction with 4 steps

1.1: hydrogen; palladium 10% on activated carbon; hydrogenchloride / methanol; water / 24 h / 20 °C

2.1: ethanol / 0.33 h / 0 - 20 °C

2.2: 0.83 h / 100 °C

3.1: hydrogenchloride / water / Reflux

4.1: lithium hydroxide monohydrate; N,N,N',N'-tetramethylguanidine; lithium chloride / dimethyl sulfoxide / 40 h / 30 - 35 °C

With hydrogenchloride; lithium hydroxide monohydrate; palladium 10% on activated carbon; hydrogen; lithium chloride; N,N,N',N'-tetramethylguanidine; In methanol; ethanol; water; dimethyl sulfoxide;
DOI:10.1016/j.ejmech.2015.08.015

Reference yield:

: 189281-24-1
2-amino-6-tert-butylamino-3,5-diflouropyridine

: 888032-58-4
WQ-3810

Guidance literature:: Multi-step reaction with 3 steps

1.1: ethanol / 0.33 h / 0 - 20 °C

1.2: 0.83 h / 100 °C

2.1: hydrogenchloride / water / Reflux

3.1: lithium hydroxide monohydrate; N,N,N',N'-tetramethylguanidine; lithium chloride / dimethyl sulfoxide / 40 h / 30 - 35 °C

With hydrogenchloride; lithium hydroxide monohydrate; lithium chloride; N,N,N',N'-tetramethylguanidine; In ethanol; water; dimethyl sulfoxide;
DOI:10.1016/j.ejmech.2015.08.015