Mivavotinib

Base Information

Chemical Name:Mivavotinib
CAS No.:1312691-33-0
Molecular Formula:C₁₇H₂₁FN₆O
Molecular Weight:344.392
Hs Code.:
UNII:8QR88H79VX
Wikidata:Q105337798
NCI Thesaurus Code:C113162
Pharos Ligand ID:LZQBFQ9VBBUK
ChEMBL ID:CHEMBL3979920
Mol file:1312691-33-0.mol

Synonyms:TAK-659

Suppliers and Price of Mivavotinib

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
TAK-659freebase(Mivavotinib) >98%
250 mg
$ 900.00

DC Chemicals
TAK-659freebase(Mivavotinib) >98%
1 g
$ 1800.00

DC Chemicals
TAK-659freebase(Mivavotinib) >98%
100 mg
$ 500.00

Biorbyt Ltd
TAK-659 free base
1 g
$ 2691.10

Biorbyt Ltd
TAK-659 free base
250 mg
$ 1356.60

Biorbyt Ltd
TAK-659 free base
100 mg
$ 765.00

Total 7 raw suppliers

Chemical Property of Mivavotinib

Chemical Property:

Boiling Point:661.7±55.0 °C(Predicted)
PKA:10.90±0.20(Predicted)
Density:1.58±0.1 g/cm3(Predicted)
XLogP3:0.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:344.17608748
Heavy Atom Count:25
Complexity:508

Purity/Quality:

98% ^*data from raw suppliers

TAK-659freebase(Mivavotinib) >98% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CN1C=C(C=N1)C2=NC(=C(C3=C2C(=O)NC3)F)NC4CCCCC4N
Isomeric SMILES:CN1C=C(C=N1)C2=NC(=C(C3=C2C(=O)NC3)F)N[C@@H]4CCCC[C@@H]4N
Recent ClinicalTrials:Study of Mivavotinib (CB-659) in Relapsed/Refractory Diffuse Large B-Cell Lymphoma (DLBCL)
Recent EU Clinical Trials:Phase 2 Study of TAK-659 in Patients With Relapsed or Refractory Diffuse Large B-Cell Lymphoma After at Least 2 Prior Lines of Chemotherapy

Technology Process of Mivavotinib

There total 7 articles about Mivavotinib 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: 96.0%

: (3aR,7aS)-tert-butyl 3-(2-(tert-butoxycarbonyl)-4-chloro-7-fluoro-3-oxo-2,3-dihydro-1H-pyrrolo[3 ,4-c]pyridin-6-yl)octahydro-1H-benzo[d]imidazole-1-carboxylate

: 1312691-33-0
6-(((1R,2S)-2-aminocyclohexyl)amino)-7-fluoro-4-(1-methyl-1H-pyrazol-4-yl)-1H-pyrrolo[3,4-c]pyridin-3(2H)-one

Guidance literature:: (3aR,7aS)-tert-butyl 3-(2-(tert-butoxycarbonyl)-4-chloro-7-fluoro-3-oxo-2,3-dihydro-1H-pyrrolo[3 ,4-c]pyridin-6-yl)octahydro-1H-benzo[d]imidazole-1-carboxylate; With trifluoroacetic acid; at 20 ℃; for 0.5h;

With hydrazine hydrate; sodium hydroxide; In ethanol; water; at 4 - 41 ℃;

Reference yield: 88.0%

: 6-(((1R,2S)-2-aminocyclohexyl)amino)-7-fluoro-4-(1-methyl-1H-pyrazol-4-yl)-1H-pyrrolo[3,4-c]pyridin-3(2H)-one citrate

: 1312691-33-0
6-(((1R,2S)-2-aminocyclohexyl)amino)-7-fluoro-4-(1-methyl-1H-pyrazol-4-yl)-1H-pyrrolo[3,4-c]pyridin-3(2H)-one

Guidance literature:: With sodium hydroxide; In water; acetonitrile; at 60 ℃; for 1h;

Reference yield: 79.0%

: 1312691-42-1
tert-butyl (1S,2R)-2-(2-(2,4-dimethoxybenzyl)-7-fluoro-4-(1-methyl-1H-pyrazol-4-yl)-3-oxo-2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-6-ylamino)cyclohexylcarbamate

: 1312691-33-0
6-(((1R,2S)-2-aminocyclohexyl)amino)-7-fluoro-4-(1-methyl-1H-pyrazol-4-yl)-1H-pyrrolo[3,4-c]pyridin-3(2H)-one

Guidance literature:: tert-butyl (1S,2R)-2-(2-(2,4-dimethoxybenzyl)-7-fluoro-4-(1-methyl-1H-pyrazol-4-yl)-3-oxo-2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-6-ylamino)cyclohexylcarbamate; With trifluoroacetic acid; at 80 ℃; for 0.5h;

With sodium hydrogencarbonate; In water; ethyl acetate;