2-[4-(methylsulfanyl)phenyl]-2,3-dihydro-4(1H)-quinazolinone

Base Information

• Chemical Name: 2-[4-(methylsulfanyl)phenyl]-2,3-dihydro-4(1H)-quinazolinone
• CAS No.: 329195-68-8
• Molecular Formula: C₁₅H₁₄N₂OS
• Molecular Weight: 270.355
• DSSTox Substance ID: DTXSID601326483
• ChEMBL ID: CHEMBL1704039
• Mol file: 329195-68-8.mol

Synonyms:2-[4-(methylsulfanyl)phenyl]-2,3-dihydro-4(1H)-quinazolinone;2-(4-methylsulfanylphenyl)-2,3-dihydro-1H-quinazolin-4-one;MLS001180553;329195-68-8;SMR000476676;CBMicro_000642;Oprea1_772103;CHEMBL1704039;cid_2867455;BDBM100091;DTXSID601326483;HMS1698D03;HMS2777M10;SMSF0007384;STK363402;AKOS000657116;AKOS022070099;CB01906;BIM-0000784.P001;AB00096320-01;AK-968/12118503;SR-01000219439;SR-01000219439-1;Z48978406;2-[4-(methylthio)phenyl]-2,3-dihydro-1H-quinazolin-4-one;2-[4-(methylsulfanyl)phenyl]-2,3-dihydroquinazolin-4(1H)-one

Chemical Property of 2-[4-(methylsulfanyl)phenyl]-2,3-dihydro-4(1H)-quinazolinone

Chemical Property:

• XLogP3: 3.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 270.08268425
• Heavy Atom Count: 19
• Complexity: 328

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CSC1=CC=C(C=C1)C2NC3=CC=CC=C3C(=O)N2

Technology Process of 2-[4-(methylsulfanyl)phenyl]-2,3-dihydro-4(1H)-quinazolinone

There total 1 articles about 2-[4-(methylsulfanyl)phenyl]-2,3-dihydro-4(1H)-quinazolinone 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: 88.0%

anthranilic acid amide (28144-70-9,88-68-6) + 4-(Methylthio)benzaldehyde (3446-89-7) → 2-(4-(methylthio)phenyl)-2,3-dihydroquinazolin-4(1H)-one (329195-68-8)

Guidance literature:

With 25,26,27,28-terahydroxycalix[4]arene-5,11,7,23-tetrasulfonic acid; In water; at 20 ℃; for 0.333333h; Green chemistry;

DOI:10.1039/c4ra16374e

upstream raw materials:

anthranilic acid amide

4-(Methylthio)benzaldehyde