1-Benzyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid

Base Information

Chemical Name:1-Benzyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid
CAS No.:115274-33-4
Molecular Formula:C₂₀H₁₉FN₄O₃
Molecular Weight:382.394
Hs Code.:
DSSTox Substance ID:DTXSID90554845
Wikidata:Q82436021
Mol file:115274-33-4.mol

Synonyms:115274-33-4;1-BENZYL-6-FLUORO-4-OXO-7-PIPERAZIN-1-YL-1,4-DIHYDRO-[1,8]NAPHTHYRIDINE-3-CARBOXYLIC ACID;1-benzyl-6-fluoro-4-oxo-7-piperazin-1-yl-1,8-naphthyridine-3-carboxylic acid;1-Benzyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid;DTXSID90554845

Suppliers and Price of 1-Benzyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid

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

American Custom Chemicals Corporation
1-BENZYL-6-FLUORO-4-OXO-7-PIPERAZIN-1-YL-1,4-DIHYDRO[1,8]NAPHTHYRIDINE-3-CARBOXYLIC ACID 95.00%
5MG
$ 499.93

Total 1 raw suppliers

Chemical Property of 1-Benzyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid

Chemical Property:

Melting Point:249-251 °C
Boiling Point:648.2±55.0 °C(Predicted)
PKA:6.03±0.70(Predicted)
PSA：87.46000
Density:1.408±0.06 g/cm3(Predicted)
LogP:2.08550
XLogP3:0.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:4
Exact Mass:382.14411864
Heavy Atom Count:28
Complexity:631

Purity/Quality:: 1-BENZYL-6-FLUORO-4-OXO-7-PIPERAZIN-1-YL-1,4-DIHYDRO[1,8]NAPHTHYRIDINE-3-CARBOXYLIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1CN(CCN1)C2=C(C=C3C(=O)C(=CN(C3=N2)CC4=CC=CC=C4)C(=O)O)F

Technology Process of 1-Benzyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid

There total 2 articles about 1-Benzyl-6-fluoro-4-oxo-7-(piperazin-1-yl)-1,4-dihydro-1,8-naphthyridine-3-carboxylic acid 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: 30.0%

: 115274-45-8
7-(4-Acetyl-piperazin-1-yl)-1-benzyl-6-fluoro-4-oxo-1,4-dihydro-[1,8]naphthyridine-3-carboxylic acid ethyl ester

: 115274-33-4
1-Benzyl-6-fluoro-4-oxo-7-piperazin-1-yl-1,4-dihydro-[1,8]naphthyridine-3-carboxylic acid

Guidance literature:: With hydrogenchloride; ammonium hydroxide; for 4h; Heating;
DOI:10.1248/cpb.36.1223

Reference yield:

: 84233-60-3
ethyl 7-(4-acetyl-1-piperazinyl)-6-fluoro-1,4-dihydro-4-oxo-1,8-naphthyridine-3-carboxylate

: 115274-33-4
1-Benzyl-6-fluoro-4-oxo-7-piperazin-1-yl-1,4-dihydro-[1,8]naphthyridine-3-carboxylic acid

Guidance literature:: Multi-step reaction with 2 steps

1: 78 percent / K₂CO₃ / dimethylformamide / 5 h / 80 °C

2: 30 percent / 1.) 20 percent HCl, 2.) NH₄OH / 4 h / Heating

With hydrogenchloride; ammonium hydroxide; potassium carbonate; In N,N-dimethyl-formamide;
DOI:10.1248/cpb.36.1223