Hexahydro-N-((2-(5-nitro-2-furanyl)-4-thiazolyl)methylene)-1H-azepin-1-amine

Base Information

Chemical Name:Hexahydro-N-((2-(5-nitro-2-furanyl)-4-thiazolyl)methylene)-1H-azepin-1-amine
CAS No.:31898-54-1
Molecular Formula:C₁₄H₁₆N₄O₃S
Molecular Weight:320.372
Hs Code.:
ChEMBL ID:CHEMBL3273836
Mol file:31898-54-1.mol

Synonyms:BRN 0564610;Hexahydro-N-((2-(5-nitro-2-furanyl)-4-thiazolyl)methylene)-1H-azepin-1-amine;1H-Azepin-1-amine, hexahydro-N-((2-(5-nitro-2-furanyl)-4-thiazolyl)methylene)-;31898-54-1;CHEMBL3273836;LS-22787

Suppliers and Price of Hexahydro-N-((2-(5-nitro-2-furanyl)-4-thiazolyl)methylene)-1H-azepin-1-amine

Supply Marketing:

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

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Chemical Property of Hexahydro-N-((2-(5-nitro-2-furanyl)-4-thiazolyl)methylene)-1H-azepin-1-amine

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Boiling Point:528.7°Cat760mmHg
Flash Point:273.5°C
Density:1.46g/cm³
XLogP3:3.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:3
Exact Mass:320.09431156
Heavy Atom Count:22
Complexity:409

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CCCN(CC1)N=CC2=CSC(=N2)C3=CC=C(O3)[N+](=O)[O-]
Isomeric SMILES:C1CCCN(CC1)/N=C/C2=CSC(=N2)C3=CC=C(O3)[N+](=O)[O-]

Technology Process of Hexahydro-N-((2-(5-nitro-2-furanyl)-4-thiazolyl)methylene)-1H-azepin-1-amine

There total 6 articles about Hexahydro-N-((2-(5-nitro-2-furanyl)-4-thiazolyl)methylene)-1H-azepin-1-amine 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:

: 59-84-7
5-nitrofuran-2-carbothioamide

: 31898-54-1
azepan-1-yl-[2-(5-nitro-furan-2-yl)-thiazol-4-ylmethylene]-amine

Guidance literature:: Multi-step reaction with 5 steps

1: dimethylformamide

2: dimethylformamide

3: aq. HCl / dioxane

4: Na₂Cr₂O₇*2H₂O / acetic acid

5: AcOH / CHCl₃

With hydrogenchloride; sodium dichromate; acetic acid; In 1,4-dioxane; chloroform; acetic acid; N,N-dimethyl-formamide;
DOI:10.1021/jm00217a017

Reference yield:

: 31898-51-8
[2-(5-nitro-furan-2-yl)-thiazol-4-yl]-methanol

: 31898-54-1
azepan-1-yl-[2-(5-nitro-furan-2-yl)-thiazol-4-ylmethylene]-amine

Guidance literature:: Multi-step reaction with 2 steps

1: Na₂Cr₂O₇*2H₂O / acetic acid

2: AcOH / CHCl₃

With sodium dichromate; acetic acid; In chloroform; acetic acid;
DOI:10.1021/jm00217a017

Reference yield:

: 13218-17-2
4-chloromethyl-2-(5-nitro-furan-2-yl)-thiazole

: 31898-54-1
azepan-1-yl-[2-(5-nitro-furan-2-yl)-thiazol-4-ylmethylene]-amine

Guidance literature:: Multi-step reaction with 4 steps

1: dimethylformamide

2: aq. HCl / dioxane

3: Na₂Cr₂O₇*2H₂O / acetic acid

4: AcOH / CHCl₃

With hydrogenchloride; sodium dichromate; acetic acid; In 1,4-dioxane; chloroform; acetic acid; N,N-dimethyl-formamide;
DOI:10.1021/jm00217a017