1,2,4-Triazolo[3,4-b]benzothiazole-3(2H)-thione
![1,2,4-Triazolo[3,4-b]benzothiazole-3(2H)-thione Structure](https://image.chemsrc.com/caspic/059/6957-85-3.png)
1,2,4-Triazolo[3,4-b]benzothiazole-3(2H)-thione structure
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Common Name | 1,2,4-Triazolo[3,4-b]benzothiazole-3(2H)-thione | ||
|---|---|---|---|---|
| CAS Number | 6957-85-3 | Molecular Weight | 207.27500 | |
| Density | 1.73 g/cm3 | Boiling Point | 339.6ºC at 760 mmHg | |
| Molecular Formula | C8H5N3S2 | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 159.2ºC | |
| Name | 2H-[1,2,4]triazolo[3,4-b][1,3]benzothiazole-1-thione |
|---|---|
| Synonym | More Synonyms |
| Density | 1.73 g/cm3 |
|---|---|
| Boiling Point | 339.6ºC at 760 mmHg |
| Molecular Formula | C8H5N3S2 |
| Molecular Weight | 207.27500 |
| Flash Point | 159.2ºC |
| Exact Mass | 206.99200 |
| PSA | 93.42000 |
| LogP | 2.60660 |
| Index of Refraction | 1.935 |
| InChIKey | QTXZICUYCJDYLP-UHFFFAOYSA-N |
| SMILES | S=c1[nH]nc2sc3ccccc3n12 |
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
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| Hazard Codes | Xi: Irritant; |
|---|---|
| HS Code | 2934100090 |
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~90%
1,2,4-Triazolo[... CAS#:6957-85-3 |
| Literature: Aboelmagd; Ali, Ibrahim A.I.; Salem, Ezzeldin M.S.; Abdel-Razik European Journal of Medicinal Chemistry, 2013 , vol. 60, p. 503 - 511 |
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~%
1,2,4-Triazolo[... CAS#:6957-85-3 |
| Literature: Polish Journal of Chemistry, , vol. 57, # 1-3 p. 341 - 344 |
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~%
1,2,4-Triazolo[... CAS#:6957-85-3 |
| Literature: European Journal of Medicinal Chemistry, , vol. 60, p. 503 - 511 |
|
~61%
1,2,4-Triazolo[... CAS#:6957-85-3 |
| Literature: Kossowska, Barbara; Prelicz, Danuta; Utko, Krystyna; Wyzygowska, Lidia Polish Journal of Chemistry, 1983 , vol. 57, # 1-3 p. 341 - 344 |
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~%
1,2,4-Triazolo[... CAS#:6957-85-3 |
| Literature: Polish Journal of Chemistry, , vol. 57, # 1-3 p. 341 - 344 |
|
~%
1,2,4-Triazolo[... CAS#:6957-85-3 |
| Literature: Indian Journal of Chemistry, , vol. 11, p. 321 - 324 |
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~%
1,2,4-Triazolo[... CAS#:6957-85-3 |
| Literature: Indian Journal of Chemistry, , vol. 11, p. 321 - 324 |
|
~%
1,2,4-Triazolo[... CAS#:6957-85-3 |
| Literature: Polish Journal of Chemistry, , vol. 57, # 1-3 p. 341 - 344 |
|
~%
1,2,4-Triazolo[... CAS#:6957-85-3 |
| Literature: Indian Journal of Chemistry, , vol. 11, p. 321 - 324 |
| HS Code | 2934100090 |
|---|---|
| Summary | 2934100090 other compounds containing an unfused thiazole ring (whether or not hydrogenated) in the structure VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:20.0% |
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Name: Antifungal activity against Candida albicans up to 24 hrs
Source: ChEMBL
Target: Candida albicans
External Id: CHEMBL2394319
|
|
Name: Luminescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id: OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
|
|
Name: QFRET-based biochemical primary high throughput screening assay to identify exosite i...
Source: The Scripps Research Institute Molecular Screening Center
Target: disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id: ADAM17_INH_QFRET_1536_1X%INH PRUN
|
|
Name: Antifungal activity against Candida albicans at 500 ppm
Source: ChEMBL
Target: Candida albicans
External Id: CHEMBL2394323
|
|
Name: Antifungal activity against Aspergillus flavus by agar diffusion technique
Source: ChEMBL
Target: Aspergillus flavus
External Id: CHEMBL2394322
|
|
Name: Fluorescence-based cell-based primary high throughput screening assay to identify ago...
Source: The Scripps Research Institute Molecular Screening Center
Target: muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id: CHRM1_AG_FLUO8_1536_1X%ACT PRUN
|
|
Name: Antifungal activity against Aspergillus flavus up to 24 hrs
Source: ChEMBL
Target: Aspergillus flavus
External Id: CHEMBL2394321
|
|
Name: Antifungal activity against Candida albicans by agar diffusion technique
Source: ChEMBL
Target: Candida albicans
External Id: CHEMBL2394320
|
|
Name: Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
Source: Broad Institute
Target: FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id: 2147-01_Inhibitor_SinglePoint_HTS_Activity
|
|
Name: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
Source: Broad Institute
Target: N/A
External Id: Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
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| s-Triazolo(3,4-b)benzothiazol-3-thiol |
| 10-mercapto-2,3-azinomethylbenzothiazole |
| [1,2,4]triazolo[3,4-b][1,3]benzothiazole-3-thiol |
| s-Triazolo[3,4-b]benzothiazole-3-thiol |
| benzo[4,5]thiazolo[2,3-c][1,2,4]triazole-3-thiol |
| 3-mercapto-7-thia-1,2,3-triazacyclopentaindene |
| 2H-Benzo[4,5]thiazolo[2,3-c][1,2,4]triazole-3-thione |
| 1,2,4-Triazolo(3,4-b)benzothiazole-3(2H)-thione |