1,8-Naphthyridine-3-carboxylic acid, 1,4-dihydro-1-ethenyl-6-fluoro-7-(3-(methylamino)-1-pyrrolidinyl)-4-oxo-

Base Information

Chemical Name:1,8-Naphthyridine-3-carboxylic acid, 1,4-dihydro-1-ethenyl-6-fluoro-7-(3-(methylamino)-1-pyrrolidinyl)-4-oxo-
CAS No.:84424-13-5
Molecular Formula:C₁₆H₁₇FN₄O₃
Molecular Weight:332.334
Hs Code.:
DSSTox Substance ID:DTXSID101004688
ChEMBL ID:CHEMBL412431
Mol file:84424-13-5.mol

Synonyms:84424-13-5;BRN 5617062;1,8-Naphthyridine-3-carboxylic acid, 1,4-dihydro-1-ethenyl-6-fluoro-7-(3-(methylamino)-1-pyrrolidinyl)-4-oxo-;6-Fluoro-7-(3-(methylamino)pyrrolidin-1-yl)-4-oxo-1-vinyl-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid;1-Ethenyl-6-fluoro-7-[3-(methylamino)pyrrolidin-1-yl]-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid;CHEMBL412431;SCHEMBL11192089;DTXSID101004688;LS-95940;1-Ethenyl-6-fluoro-7-(3-methylaminopyrrolidin-1-yl)-4-oxo-1,8-naphthyr idine-3-carboxylic acid

Suppliers and Price of 1,8-Naphthyridine-3-carboxylic acid, 1,4-dihydro-1-ethenyl-6-fluoro-7-(3-(methylamino)-1-pyrrolidinyl)-4-oxo-

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
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Total 4 raw suppliers

Chemical Property of 1,8-Naphthyridine-3-carboxylic acid, 1,4-dihydro-1-ethenyl-6-fluoro-7-(3-(methylamino)-1-pyrrolidinyl)-4-oxo-

Chemical Property:

Vapor Pressure:2.66E-13mmHg at 25°C
Boiling Point:558.3°C at 760 mmHg
Flash Point:291.5°C
PSA：87.46000
Density:1.44g/cm³
LogP:1.58830
XLogP3:0.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:4
Exact Mass:332.12846858
Heavy Atom Count:24
Complexity:582

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CNC1CCN(C1)C2=C(C=C3C(=O)C(=CN(C3=N2)C=C)C(=O)O)F

Technology Process of 1,8-Naphthyridine-3-carboxylic acid, 1,4-dihydro-1-ethenyl-6-fluoro-7-(3-(methylamino)-1-pyrrolidinyl)-4-oxo-

There total 4 articles about 1,8-Naphthyridine-3-carboxylic acid, 1,4-dihydro-1-ethenyl-6-fluoro-7-(3-(methylamino)-1-pyrrolidinyl)-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: 87.0%

: 84424-14-6
6-Fluoro-7-{3-[methyl-(2,2,2-trifluoro-acetyl)-amino]-pyrrolidin-1-yl}-4-oxo-1-vinyl-1,4-dihydro-[1,8]naphthyridine-3-carboxylic acid ethyl ester

: 84424-13-5
6-fluoro-1,4-dihydro-7-(3-methylamino-1-pyrrolidinyl)-4-oxo-1-vinyl-1,8-naphthyridine-3-carboxylic acid

Guidance literature:: With sodium hydroxide; In ethanol; Heating;
DOI:10.1021/jm00378a004

Reference yield:

: 84424-27-1
6-fluoro-1,4-dihydro-7-hydroxy-4-oxo-1-vinyl-1,8-naphthyridine-3-carboxylic acid

: 84424-13-5
6-fluoro-1,4-dihydro-7-(3-methylamino-1-pyrrolidinyl)-4-oxo-1-vinyl-1,8-naphthyridine-3-carboxylic acid

Guidance literature:: Multi-step reaction with 4 steps

1: POCl₃ / 0.1 h / 115 °C

2: CHCl₃ / 0.5 h / 40 °C

3: 73 percent / Et₃N / ethanol / Heating

4: 87 percent / aq. NaOH / ethanol / Heating

With sodium hydroxide; triethylamine; trichlorophosphate; In ethanol; chloroform;
DOI:10.1021/jm00378a004

Reference yield:

: 87939-15-9
ethyl 7-(4-acetyl-1-piperazinyl)-1-(2-chloroethyl)-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylate

: 84424-13-5
6-fluoro-1,4-dihydro-7-(3-methylamino-1-pyrrolidinyl)-4-oxo-1-vinyl-1,8-naphthyridine-3-carboxylic acid

Guidance literature:: Multi-step reaction with 5 steps

1: 1.) KOH, 2.) aq. NaOH / 1.) EtOH, reflux, 2 h, 2.) EtOH, 120 deg C, 18 h

2: POCl₃ / 0.1 h / 115 °C

3: CHCl₃ / 0.5 h / 40 °C

4: 73 percent / Et₃N / ethanol / Heating

5: 87 percent / aq. NaOH / ethanol / Heating

With potassium hydroxide; sodium hydroxide; triethylamine; trichlorophosphate; In ethanol; chloroform;
DOI:10.1021/jm00378a004