3-(2-chlorobenzyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one

Base Information

Chemical Name:3-(2-chlorobenzyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one
CAS No.:36120-41-9
Molecular Formula:C₁₅H₁₁ClN₂OS
Molecular Weight:302.784
Hs Code.:
DSSTox Substance ID:DTXSID701324535
ChEMBL ID:CHEMBL1441040
Mol file:36120-41-9.mol

Synonyms:36120-41-9;3-(2-chlorobenzyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one;3-[(2-chlorophenyl)methyl]-2-sulfanyl-3,4-dihydroquinazolin-4-one;3-[(2-chlorophenyl)methyl]-2-sulfanylidene-1H-quinazolin-4-one;3-(2-chlorobenzyl)-2-thioxo-2,3-dihydro-4(1H)-quinazolinone;3-[(2-chlorophenyl)methyl]-2-sulfanylidene-1,2,3,4-tetrahydroquinazolin-4-one;Oprea1_251995;MLS001201108;CHEMBL1441040;DTXSID701324535;HMS2853M14;BBL004668;STK464120;STL080833;AKOS001038779;AKOS003365315;WAY-613823;SMR000564204;VS-01543;CS-0348842;EN300-04749;AB00117630-01;AQ-968/42007849;SR-01000556677;3-(2-chlorobenzyl)-2-sulfanyl-4(3H)-quinazolinone;3-(2-chlorobenzyl)-2-sulfanylquinazolin-4(3H)-one;SR-01000556677-1;Z56865126;3-(2-chlorobenzyl)-2,3-dihydro-2-thioxoquinazolin-4(1h)-one

Suppliers and Price of 3-(2-chlorobenzyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

AK Scientific
3-(2-chlorobenzyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one
20mg
$ 267.00

AK Scientific
3-(2-chlorobenzyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one
100mg
$ 537.00

aablocks
3-[(2-chlorophenyl)methyl]-2-sulfanyl-3,4-dihydroquinazolin-4-one
5g
$ 2973.00

aablocks
3-[(2-chlorophenyl)methyl]-2-sulfanyl-3,4-dihydroquinazolin-4-one
1g
$ 673.00

aablocks
3-[(2-chlorophenyl)methyl]-2-sulfanyl-3,4-dihydroquinazolin-4-one
500mg
$ 385.00

Total 4 raw suppliers

Chemical Property of 3-(2-chlorobenzyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one

Chemical Property:

XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:302.0280618
Heavy Atom Count:20
Complexity:403

Purity/Quality:

99% ^*data from raw suppliers

3-(2-chlorobenzyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC=C(C(=C1)CN2C(=O)C3=CC=CC=C3NC2=S)Cl

Technology Process of 3-(2-chlorobenzyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one

There total 8 articles about 3-(2-chlorobenzyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one 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: 90.73%

: 75-15-0,12122-00-8
carbon disulfide

: 117507-62-7
2-amino-N-[(2-chlorophenyl)methyl]benzamide

: 36120-41-9
3‐(2‐chlorobenzyl)‐2‐thioxo‐2,3‐dihydroquinazolin‐4(1H)‐one

Guidance literature:: With potassium hydroxide; In ethanol; water; at 55 ℃; for 6h;
DOI:10.1016/j.molstruc.2021.131367

Reference yield: 85.0%

: 118-48-9
isatoic anhydride

: 333-20-0
potassium thioacyanate

: 89-97-4
2-CHLOROBENZYLAMINE

: 36120-41-9
3‐(2‐chlorobenzyl)‐2‐thioxo‐2,3‐dihydroquinazolin‐4(1H)‐one

Guidance literature:: isatoic anhydride; 2-CHLOROBENZYLAMINE; In water; at 20 ℃; for 1h; Green chemistry;

potassium thioacyanate; With acetic acid; In water; for 3h; Heating; Green chemistry;
DOI:10.1080/17415993.2017.1325891

Reference yield: 69.0%

: 610-94-6
2-bromobenzoic acid methyl ester

: 18967-44-7
o-chlorobenzyl isothiocyanate

: 36120-41-9
3‐(2‐chlorobenzyl)‐2‐thioxo‐2,3‐dihydroquinazolin‐4(1H)‐one

Guidance literature:: 2-bromobenzoic acid methyl ester; With sodium azide; potassium carbonate; L-proline; copper(I) bromide; In dimethyl sulfoxide; at 85 ℃; for 3h;

o-chlorobenzyl isothiocyanate; In dimethyl sulfoxide; at 85 ℃; for 4h;
DOI:10.1002/aoc.4635