4-benzothiazol-2-ylsulfanylbutanoate

Modify Date: 2025-11-26 17:52:55

4-benzothiazol-2-ylsulfanylbutanoate Structure
4-benzothiazol-2-ylsulfanylbutanoate structure
Common Name 4-benzothiazol-2-ylsulfanylbutanoate
CAS Number 80357-74-0 Molecular Weight 253.34100
Density 1.39g/cm3 Boiling Point 461.6ºC at 760 mmHg
Molecular Formula C11H11NO2S2 Melting Point N/A
MSDS N/A Flash Point 233ºC

 Names

Name 4-(1,3-benzothiazol-2-ylsulfanyl)butanoic acid

 Chemical & Physical Properties

Density 1.39g/cm3
Boiling Point 461.6ºC at 760 mmHg
Molecular Formula C11H11NO2S2
Molecular Weight 253.34100
Flash Point 233ºC
Exact Mass 253.02300
PSA 103.73000
LogP 3.25320
Index of Refraction 1.678
InChIKey VLBFSFGWNXSNRM-UHFFFAOYSA-N
SMILES O=C(O)CCCSc1nc2ccccc2s1

 Safety Information

HS Code 2934200090

 Precursor & DownStream

Precursor  2

DownStream  0

 Customs

HS Code 2934200090
Summary 2934200090. other compounds containing in the structure a benzothiazole ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

 4-benzothiazol-2-ylsulfanylbutanoateBioassay

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Name: Assays to identify small molecules inhibitory for eIF4E expression
Source: 13133
Target: N/A
External Id: 20160513eIF4E
Name: Cell survival assay for modulators of telomere damage signalling
Source: 15378
Target: N/A
External Id: TELO_02
Name: Discovery of Small Molecules to Inhibit Human Cytomegalovirus Nuclear Egress
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: HCMV UL50
External Id: HMS1262
Name: Small-molecule inhibitors of ST2 (IL1RL1)
Source: 20881
Target: interleukin-1 receptor-like 1 isoform [homo sapiens]
External Id: ST2_IL33_Inhibitors_Primary_Screening_77700
Name: Inhibitors of CDC25B-CDK2/CyclinA interaction
Source: Center for Chemical Genomics, University of Michigan
External Id: MScreen:TargetID_600
Name: A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id: HMS979
Name: A screen for compounds that inhibit viral RNA polymerase binding and polymerization a...
Source: ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
Target: Chain A, Poliovirus Polymerase With Gtp
External Id: HMS750
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