5-[(Benzylsulfanyl)(4-methylanilino)methylidene]-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione

Base Information

Chemical Name:5-[(Benzylsulfanyl)(4-methylanilino)methylidene]-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
CAS No.:5869-39-6
Molecular Formula:C21H21N3O3S
Molecular Weight:395.4747
Hs Code.:
DSSTox Substance ID:DTXSID40422409

Synonyms:5869-39-6;DTXSID40422409;5-[(Benzylsulfanyl)(4-methylanilino)methylidene]-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione

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

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Chemical Property of 5-[(Benzylsulfanyl)(4-methylanilino)methylidene]-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione

Chemical Property:

Vapor Pressure:5.54E-10mmHg at 25°C
Boiling Point:496.2°Cat760mmHg
Flash Point:253.9°C
Density:1.326g/cm³
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:395.13036271
Heavy Atom Count:28
Complexity:662

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC=C(C=C1)N=C(C2=C(N(C(=O)N(C2=O)C)C)O)SCC3=CC=CC=C3

Technology Process of 5-[(Benzylsulfanyl)(4-methylanilino)methylidene]-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione

There total 6 articles about 5-[(Benzylsulfanyl)(4-methylanilino)methylidene]-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-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:

: 5869-10-3
6'.7'-Dimethoxy-1'.4'.9'.10'-tetrahydrospiro<1.3-dioxolan-2'.3'(2'H)-phenanthren>

: 5869-39-6
Methyl-1,2,3,4,4aα,9,10,10aβ-octahydro-6,7-dimethoxy-3-oxo-2-phenanthrencarboxylat

Guidance literature:: Multi-step reaction with 3 steps

1: (i) K, liq. NH₃, THF, (ii) aq. HCl

2: aq. NaOH

3: NaH / xylene

With sodium hydroxide; sodium hydride; In xylene;
DOI:10.1021/jm00321a009

Reference yield:

: 1,4,4aα,9,10,10aβ-Hexahydro-6-methoxy-7-hydroxy-3(2H)-phenanthrenon

: 5869-39-6
Methyl-1,2,3,4,4aα,9,10,10aβ-octahydro-6,7-dimethoxy-3-oxo-2-phenanthrencarboxylat

Guidance literature:: Multi-step reaction with 2 steps

1: aq. NaOH

2: NaH / xylene

With sodium hydroxide; sodium hydride; In xylene;
DOI:10.1021/jm00321a009

Reference yield:

: 6'.7'-Dimethoxy-1'.4'.4'aα,9'.10'.10'aβ-hexahydrospiro<1.3-dioxolan-2.3'(2'H)-phenanthren>

: 5869-39-6
Methyl-1,2,3,4,4aα,9,10,10aβ-octahydro-6,7-dimethoxy-3-oxo-2-phenanthrencarboxylat

Guidance literature:: Multi-step reaction with 2 steps

1: aq. HCl / methanol

2: NaH / xylene

With hydrogenchloride; sodium hydride; In methanol; xylene;
DOI:10.1021/jm00321a009