1-[5-(Benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(3,4-dichlorophenyl)urea

Base Information

Chemical Name:1-[5-(Benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(3,4-dichlorophenyl)urea
CAS No.:6066-87-1
Molecular Formula:C17H14Cl2N4OS2
Molecular Weight:425.3553
Hs Code.:
DSSTox Substance ID:DTXSID90362260
Wikidata:Q82145159

Synonyms:STK847184;6066-87-1;1-{5-[(benzylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl}-3-(3,4-dichlorophenyl)urea;CBMicro_010303;Oprea1_410315;DTXSID90362260;SMSF0012814;STK988985;AKOS005628533;AKOS030514800;CB13236;1-[5-(benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(3,4-dichlorophenyl)urea;BIM-0010432.P001;1-[(2E)-5-[(benzylsulfanyl)methyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3-(3,4-dichlorophenyl)urea;424815-10-1

Suppliers and Price of 1-[5-(Benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(3,4-dichlorophenyl)urea

Supply Marketing:

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

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Chemical Property of 1-[5-(Benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(3,4-dichlorophenyl)urea

Chemical Property:

Boiling Point:°Cat760mmHg
Flash Point:°C
Density:1.534g/cm³
XLogP3:4.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:423.9986088
Heavy Atom Count:26
Complexity:457

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)CSCC2=NN=C(S2)NC(=O)NC3=CC(=C(C=C3)Cl)Cl

Technology Process of 1-[5-(Benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(3,4-dichlorophenyl)urea

There total 2 articles about 1-[5-(Benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-3-(3,4-dichlorophenyl)urea 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: 59.0%

: 675-20-7
piperidin-2-one

: 6727-75-9
5-iodovaleronitrile

: 6066-87-1
5-(2-oxopiperidin-1-yl)pentanenitrile

Guidance literature:: piperidin-2-one; With potassium hydride; In tetrahydrofuran; for 3h;

5-iodovaleronitrile; In tetrahydrofuran; for 16h; Further stages.;
DOI:10.1021/jo026396+