2-Benzylthio-5-amino-1,3,4-thiadiazole

Base Information Edit

Chemical Name:2-Benzylthio-5-amino-1,3,4-thiadiazole
CAS No.:25660-71-3
Molecular Formula:C9H9N3S2
Molecular Weight:223.323
Hs Code.:2934999090
European Community (EC) Number:806-931-6
NSC Number:204491
DSSTox Substance ID:DTXSID90180365
Nikkaji Number:J1.524.510G
Wikidata:Q83050895
ChEMBL ID:CHEMBL369173
Mol file:25660-71-3.mol

Synonyms:25660-71-3;2-benzylthio-5-amino-1,3,4-thiadiazole;5-(Benzylthio)-1,3,4-thiadiazol-2-amine;5-benzylsulfanyl-1,3,4-thiadiazol-2-amine;2-amino-5-benzylthio-1,3,4-thiadiazole;5-(benzylsulfanyl)-1,3,4-thiadiazol-2-amine;5-Benzylsulfanyl-[1,3,4]thiadiazol-2-ylamine;2-Amino-5-benzylmercapto-1,3,4-thiadiazole;2-amino-5-(benzylthio)-1,3,4-thiadiazole;1,3,4-Thiadiazol-2-amine,5-[(phenylmethyl)thio]-;5-benzylsulfanyl[1,3,4]thiadiazol-2-ylamine;1,3,4-Thiadiazol-2-amine, 5-((phenylmethyl)thio)-;5-((Phenylmethyl)thio)-1,3,4-thiadiazol-2-amine;MFCD00184237;NSC204491;Oprea1_100340;Oprea1_704053;CBDivE_001722;CHEMBL369173;SCHEMBL3906094;DTXSID90180365;HMS1682N03;STK384985;AKOS000112174;AC-5579;NSC 204491;NSC-204491;5-Amino-2-benzylthio-1,3,4-thiadiazole;AS-67751;LS-150232;5-(Benzylthio)-1,3,4-thiadiazole-2-amine;5-amino-2-benzylmercapto-1,3,4-thiadiazole;FT-0638544;5-benzylsulfanyl-1,3,4-thiadiazol-2-ylamine;EN300-02885;T70666;A817954;2-Amino-5-benzylthio-1,3,4-thiadiazole, AldrichCPR;BRD-K58672433-001-01-7

Suppliers and Price of 2-Benzylthio-5-amino-1,3,4-thiadiazole

Supply Marketing:Edit

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

TRC
2-Benzylthio-5-amino-1,3,4-thiadiazole
1g
$ 275.00

TCI Chemical
2-Amino-5-(benzylthio)-1,3,4-thiadiazole >98.0%(HPLC)(T)
5g
$ 604.00

TCI Chemical
2-Amino-5-(benzylthio)-1,3,4-thiadiazole >98.0%(HPLC)(T)
1g
$ 175.00

Matrix Scientific
5-Benzylsulfanyl[1,3,4]thiadiazol-2-ylamine
1g
$ 74.00

Matrix Scientific
5-Benzylsulfanyl[1,3,4]thiadiazol-2-ylamine
500mg
$ 50.00

Crysdot
5-(Benzylthio)-1,3,4-thiadiazol-2-amine 95+%
10g
$ 377.00

Chemenu
5-(Benzylthio)-1,3,4-thiadiazol-2-amine 95%
10g
$ 356.00

Biosynth Carbosynth
5-(Benzylthio)-1,3,4-thiadiazol-2-amine
500 mg
$ 150.00

Biosynth Carbosynth
5-(Benzylthio)-1,3,4-thiadiazol-2-amine
250 mg
$ 85.00

Biosynth Carbosynth
5-(Benzylthio)-1,3,4-thiadiazol-2-amine
1 g
$ 255.00

Total 38 raw suppliers

Chemical Property of 2-Benzylthio-5-amino-1,3,4-thiadiazole Edit

Chemical Property:

Vapor Pressure:3.89E-07mmHg at 25°C
Melting Point:157.0 to 161.0 °C
Refractive Index:1.693
Boiling Point:416.2 °C at 760 mmHg
PKA:2.46±0.10(Predicted)
Flash Point:205.5 °C
PSA：105.34000
Density:1.39 g/cm³
LogP:2.99380
Storage Temp.:2-8°C
Solubility.:DMSO (Slightly), Methanol (Slightly)
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:223.02378965
Heavy Atom Count:14
Complexity:173

Purity/Quality:

99% ^*data from raw suppliers

2-Benzylthio-5-amino-1,3,4-thiadiazole ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 36/37/39

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)CSC2=NN=C(S2)N
Uses 2-Benzylthio-5-amino-1,3,4-thiadiazole is used to study and investigate its antitumor activities against human cervix adenocarcinoma(HeLa), human liver cancer cell(SMMC-7721), human breast cancer cell(MCF-7) and human lung cancer cell(A549) lines that isfurther evaluated by CCK-8 assay.

Technology Process of 2-Benzylthio-5-amino-1,3,4-thiadiazole

There total 10 articles about 2-Benzylthio-5-amino-1,3,4-thiadiazole 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: 98.0%

: 100-44-7
benzyl chloride

: 2349-67-9
2-Amino-5-mercapto-1,3,4-thiadiazole

: 25660-71-3
2-amino-5-benzylthio-1,3,4-thiadiazole

Guidance literature:: 2-Amino-5-mercapto-1,3,4-thiadiazole; With potassium hydroxide; In ethanol; water; at 20 - 30 ℃; for 0.166667h;

benzyl chloride; In ethanol; water; at 20 - 30 ℃;
DOI:10.1002/jhet.3611