Benzo[b][1,6]naphthyridine, 10-chloro-1,2,3,4-tetrahydro-2-methyl-

Base Information

• Chemical Name: Benzo[b][1,6]naphthyridine, 10-chloro-1,2,3,4-tetrahydro-2-methyl-
• CAS No.: 59194-39-7
• Molecular Formula: C13H13ClN2
• Molecular Weight: 232.713
• DSSTox Substance ID: DTXSID30483569
• Wikidata: Q82320978

Synonyms:59194-39-7;10-Chloro-2-methyl-1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridine;10-CHLORO-2-METHYL-1H,2H,3H,4H-BENZO[B]1,6-NAPHTHYRIDINE;Benzo[b][1,6]naphthyridine, 10-chloro-1,2,3,4-tetrahydro-2-methyl-;SCHEMBL6919274;DTXSID30483569;10-chloro-2-methyl-1,2,3,4-tetrahydrobenzo-[b]-1,6-naphthyridine

Chemical Property of Benzo[b][1,6]naphthyridine, 10-chloro-1,2,3,4-tetrahydro-2-methyl-

Chemical Property:

• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 232.0767261
• Heavy Atom Count: 16
• Complexity: 258

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CCC2=NC3=CC=CC=C3C(=C2C1)Cl

Technology Process of Benzo[b][1,6]naphthyridine, 10-chloro-1,2,3,4-tetrahydro-2-methyl-

There total 1 articles about Benzo[b][1,6]naphthyridine, 10-chloro-1,2,3,4-tetrahydro-2-methyl- 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:

1-Methyl-4-piperidone (1445-73-4) + anthranilic acid (118-92-3,159201-01-1,50816-84-7,80206-34-4,104809-47-4) → 2-aminobenzoyl chloride (21563-73-5) + 10-chloro-2-methyl-1,2,3,4-tetrahydro-benzo[b][1,6]naphthyridine (59194-39-7)

Guidance literature:

With phosphorus (III) oxychloride; for 2h; Heating;

DOI:10.1515/HC.2006.12.3-4.171

Reference yield: 49.0%

1-Methyl-4-piperidone (1445-73-4) + 10-chloro-2-methyl-1,2,3,4-tetrahydro-benzo[b][1,6]naphthyridine (59194-39-7) → C25H31N5

Guidance literature:

1-Methyl-4-piperidone; With anthranilic acid; trichlorophosphate; for 3h; Heating / reflux;

10-chloro-2-methyl-1,2,3,4-tetrahydro-benzo[b][1,6]naphthyridine;

Reference yield: 21.0%

N-(4-amino-3-methoxyphenyl)methanesulfonamide (57165-06-7) + 10-chloro-2-methyl-1,2,3,4-tetrahydro-benzo[b][1,6]naphthyridine (59194-39-7) → N-<4-(2-methyl-1,2,3,4-tetrahydrobenzo-1,6-naphthyridin-10-yl)amino-3-methoxyphenyl>methanesulfonamide (111232-56-5)

Guidance literature:

With sodium iodide; phenol; at 120 ℃; for 1h;

DOI:10.3987/R-1987-01-0191

upstream raw materials:

1-Methyl-4-piperidone

anthranilic acid

Downstream raw materials:

N-<4-(2-methyl-1,2,3,4-tetrahydrobenzo-1,6-naphthyridin-10-yl)amino-3-methoxyphenyl>methanesulfonamide

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