3-Quinolinecarboxylic acid, 1,4-dihydro-5-amino-1-cyclopropyl-6,8-difluoro-7-(3-methyl-1-piperazinyl)-4-oxo-

Base Information

Chemical Name:3-Quinolinecarboxylic acid, 1,4-dihydro-5-amino-1-cyclopropyl-6,8-difluoro-7-(3-methyl-1-piperazinyl)-4-oxo-
CAS No.:110871-85-7
Molecular Formula:C₁₈H₂₀F₂N₄O₃
Molecular Weight:378.379
Hs Code.:
DSSTox Substance ID:DTXSID40911883
Nikkaji Number:J324.332J
ChEMBL ID:CHEMBL15707
Mol file:110871-85-7.mol

Synonyms:MC 110;CP 135803;110871-85-7;3-Quinolinecarboxylic acid, 1,4-dihydro-5-amino-1-cyclopropyl-6,8-difluoro-7-(3-methyl-1-piperazinyl)-4-oxo-;CHEMBL15707;SCHEMBL8667072;DTXSID40911883;BJUDJYXQSBLEIA-UHFFFAOYSA-N;C18H20F2N4O3;C18-H20-F2-N4-O3;LS-141524;5-Amino-1-cyclopropyl-6,8-difluoro-1,4-dihydro-4-oxo-7-(3-methyl-1-piperazinyl)quinoline-3-carboxylic acid;5-amino-1-cyclopropyl-6,8-difluoro-7-(3-methyl-1-piperazinyl)-1,4-dihydro-4-oxoquinoline-3-carboxylic acid;5-amino-1-cyclopropyl-6,8-difluoro-7-(3-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

Suppliers and Price of 3-Quinolinecarboxylic acid, 1,4-dihydro-5-amino-1-cyclopropyl-6,8-difluoro-7-(3-methyl-1-piperazinyl)-4-oxo-

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Total 1 raw suppliers

Chemical Property of 3-Quinolinecarboxylic acid, 1,4-dihydro-5-amino-1-cyclopropyl-6,8-difluoro-7-(3-methyl-1-piperazinyl)-4-oxo-

Chemical Property:

Vapor Pressure:1.55E-17mmHg at 25°C
Boiling Point:645.4°Cat760mmHg
Flash Point:344.1°C
Density:1.494g/cm³
XLogP3:-1.3
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:9
Rotatable Bond Count:3
Exact Mass:378.15034684
Heavy Atom Count:27
Complexity:671

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1CN(CCN1)C2=C(C(=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4CC4)N)F

Technology Process of 3-Quinolinecarboxylic acid, 1,4-dihydro-5-amino-1-cyclopropyl-6,8-difluoro-7-(3-methyl-1-piperazinyl)-4-oxo-

There total 14 articles about 3-Quinolinecarboxylic acid, 1,4-dihydro-5-amino-1-cyclopropyl-6,8-difluoro-7-(3-methyl-1-piperazinyl)-4-oxo- 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: 84.0%

: 103772-14-1
5-Amino-1-cyclopropyl-6,7,8-trifluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid

: 109-07-9
(RS)-2-methylpiperazine

: 110871-85-7
5-amino-1-cyclopropyl-6,8-difluoro-7-(3-methyl-1-piperazinyl)-1,4-dihydro-4-oxoquinoline-3-carboxylic acid

Guidance literature:: With pyridine; at 80 ℃; for 0.666667h;
DOI:10.1021/jm00168a018

Reference yield:

: 110871-96-0
(+/-)-1-cyclopropyl-5,6,8-trifluoro-7-(3-methyl-1-piperazinyl)-4(1H)-oxoquinoline-3-carboxylic acid

: 110871-85-7
5-amino-1-cyclopropyl-6,8-difluoro-7-(3-methyl-1-piperazinyl)-1,4-dihydro-4-oxoquinoline-3-carboxylic acid

Guidance literature:: With ammonium hydroxide; In water;

Reference yield:

: 107564-02-3
1-cyclopropyl-5,6,7,8-tetrafluoro-1,4-dihydro-4-oxo-3-quinolinecarboxylic acid,ethyl ester

: 110871-85-7
5-amino-1-cyclopropyl-6,8-difluoro-7-(3-methyl-1-piperazinyl)-1,4-dihydro-4-oxoquinoline-3-carboxylic acid

Guidance literature:: Multi-step reaction with 3 steps

1: 79 percent / triethylamine / toluene / 1 h / Heating

2: 96 percent / acetic acid, aq. H₂SO₄ / 0.17 h / 100 °C

3: 84 percent / pyridine / 0.67 h / 80 °C

With pyridine; sulfuric acid; acetic acid; triethylamine; In toluene;
DOI:10.1021/jm00168a018