5-[[4-(Azepan-1-yl)phenyl]methylidene]-1-(2-chlorophenyl)-1,3-diazinane-2,4,6-trione

Base Information

Chemical Name:5-[[4-(Azepan-1-yl)phenyl]methylidene]-1-(2-chlorophenyl)-1,3-diazinane-2,4,6-trione
CAS No.:5270-44-0
Molecular Formula:C23H22ClN3O3
Molecular Weight:423.8921
Hs Code.:
DSSTox Substance ID:DTXSID20362773
Mol file:5270-44-0.mol

Synonyms:5270-44-0;5-[[4-(azepan-1-yl)phenyl]methylidene]-1-(2-chlorophenyl)-1,3-diazinane-2,4,6-trione;DTXSID20362773

Suppliers and Price of 5-[[4-(Azepan-1-yl)phenyl]methylidene]-1-(2-chlorophenyl)-1,3-diazinane-2,4,6-trione

Supply Marketing:

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

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Chemical Property of 5-[[4-(Azepan-1-yl)phenyl]methylidene]-1-(2-chlorophenyl)-1,3-diazinane-2,4,6-trione

Chemical Property:

Density:1.337g/cm³
XLogP3:4.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:423.1349693
Heavy Atom Count:30
Complexity:694

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CCCN(CC1)C2=CC=C(C=C2)C=C3C(=O)NC(=O)N(C3=O)C4=CC=CC=C4Cl

Technology Process of 5-[[4-(Azepan-1-yl)phenyl]methylidene]-1-(2-chlorophenyl)-1,3-diazinane-2,4,6-trione

There total 27 articles about 5-[[4-(Azepan-1-yl)phenyl]methylidene]-1-(2-chlorophenyl)-1,3-diazinane-2,4,6-trione 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%

: 31996-72-2
(+/-)-2-oxabicyclo<4.2.0>octane-7-one

: 5270-44-0
(+/-)-5,9-dioxabicyclo<4.3.0>nonan-8-one

: (4aS,7aR)-Hexahydro-furo[3,4-b]pyran-5-one

Guidance literature:: With sodium hydrogencarbonate; 3-chloro-benzenecarboperoxoic acid; In dichloromethane;
DOI:10.1016/S0957-4166(00)80245-1

Reference yield: 85.0%

: 864719-60-8
((2R,3R)-3-Hydroxy-tetrahydro-pyran-2-yl)-acetic acid

: 5270-44-0
(3aR,7aR)-hexahydrofuro[3,2-b]pyran-2-one

Guidance literature:: ((2R,3R)-3-Hydroxy-tetrahydro-pyran-2-yl)-acetic acid; With 2-chloro-1,3-dimethylimidazolinium chloride; sodium hydride; In dichloromethane; at 0 ℃; for 1h;

With dmap; In dichloromethane; at 20 ℃; for 15h;
DOI:10.1016/j.tet.2005.06.034