Methyl 2-(2-methoxyphenyl)-6-methyl-4-thioxo-2H,3H,5H-3,5-diazinecarboxylate

Base Information

• Chemical Name: Methyl 2-(2-methoxyphenyl)-6-methyl-4-thioxo-2H,3H,5H-3,5-diazinecarboxylate
• CAS No.: 134074-43-4
• Molecular Formula: C₁₄H₁₆N₂O₃S
• Molecular Weight: 292.359
• DSSTox Substance ID: DTXSID401125605
• Nikkaji Number: J370.220K
• Mol file: 134074-43-4.mol

Synonyms:134074-43-4;METHYL 2-(2-METHOXYPHENYL)-6-METHYL-4-THIOXO-2H,3H,5H-3,5-DIAZINECARBOXYLATE;methyl 4-(2-methoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate;methyl 4-(2-methoxyphenyl)-6-methyl-2-sulfanylidene-1,2,3,4-tetrahydropyrimidine-5-carboxylate;methyl 4-(2-methoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate;methyl 6-(2-methoxyphenyl)-4-methyl-2-sulfanyl-1,6-dihydropyrimidine-5-carboxylate;DTXSID401125605;MFCD00227676;STK106883;STK363156;AKOS000369156;AKOS000653084;AKOS016356885;AKOS022079797;MS-8091;CS-0328924;EU-0067391;SR-01000393591;SR-01000393591-1;Z47739104;F0095-2348;Methyl 1,2,3,4-tetrahydro-4-(2-methoxyphenyl)-6-methyl-2-thioxo-5-pyrimidinecarboxylate;6-Methyl-4-(2-methoxyphenyl)-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylic acid methyl ester

Chemical Property of Methyl 2-(2-methoxyphenyl)-6-methyl-4-thioxo-2H,3H,5H-3,5-diazinecarboxylate

Chemical Property:

• XLogP3: 1.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 292.08816355
• Heavy Atom Count: 20
• Complexity: 436

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=C(C(NC(=S)N1)C2=CC=CC=C2OC)C(=O)OC

Technology Process of Methyl 2-(2-methoxyphenyl)-6-methyl-4-thioxo-2H,3H,5H-3,5-diazinecarboxylate

There total 1 articles about Methyl 2-(2-methoxyphenyl)-6-methyl-4-thioxo-2H,3H,5H-3,5-diazinecarboxylate 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: 96.0%

acetoacetic acid methyl ester (105-45-3) + thiourea (17356-08-0) + ortho-anisaldehyde (135-02-4) → 5-methoxycarbonyl-4-(2-methoxyphenyl)-6-methyl-3,4-dihydropyrimidin-2(1H)-thione (134074-43-4)

Guidance literature:

With yttrium (III) acetate hydrate; acetic acid; at 115 ℃; for 1h;

DOI:10.5012/bkcs.2010.31.04.863

Reference yield: 79.7%

4-chlorobenzaldehyde (104-88-1) + 5-methoxycarbonyl-4-(2-methoxyphenyl)-6-methyl-3,4-dihydropyrimidin-2(1H)-thione (134074-43-4) + chloroacetic acid (79-11-8) → 2-[1-(4-Chloro-phenyl)-meth-(Z)-ylidene]-5-(2-methoxy-phenyl)-7-methyl-3-oxo-2,3-dihydro-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester

Guidance literature:

With sodium acetate; In acetic anhydride; acetic acid; for 6h; Heating;

DOI:10.1002/(SICI)1521-4184(199806)331:6<201::AID-ARDP201>3.0.CO;2-T

Reference yield: 71.0%

5-methoxycarbonyl-4-(2-methoxyphenyl)-6-methyl-3,4-dihydropyrimidin-2(1H)-thione (134074-43-4) + chloroacetone (78-95-5) → methyl 3,7-dimethyl-5-(4-methoxyphenyl)-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate

Guidance literature:

With acetic acid; for 8h; Heating;

upstream raw materials:

acetoacetic acid methyl ester

thiourea

ortho-anisaldehyde

Downstream raw materials:

methyl 3-phenyl-5-(2-methoxyphenyl)-7-methyl-5H-thiazolo<3,2-a>pyrimidine-6-carboxylate