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2-Amino-6-ethoxybenzothiazole - >97.0%, high purity , CAS No.94-45-1

COA COA
    Grade & Purity:
  • ≥97%
In stock
Item Number
A151206
Grouped product items
SKU Size
Availability
 Price Qty
A151206-5g
5g
3
$9.90
A151206-25g
25g
6
$33.90
A151206-100g
100g
6
$102.90
A151206-500g
500g
1
$394.90
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View related series
Benzothiazoles (90) Five-Membered Heterocyclic Compounds (2064)

Basic Description

Synonyms UNII-D621HZ191D | (6-ETHOXYBENZOTHIAZOL-2-YL)AMINE | 2-Benzothiazolamine, 6-ethoxy- | CAS-94-45-1 | EINECS 202-333-9 | Benzothiazole, 2-amino-6-ethoxy- | DTXCID004481 | 3-Bromoindole-1-carboxylicacidtert-butylester | 6-ethoxy-1,3-benzothiazol-2-ylamine |
Specifications & Purity ≥97%
Shipped In Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Organoheterocyclic compounds
Class Benzothiazoles
Subclass Not available
Intermediate Tree Nodes Not available
Direct Parent Benzothiazoles
Alternative Parents Alkyl aryl ethers  Benzenoids  2-amino-1,3-thiazoles  Heteroaromatic compounds  Azacyclic compounds  Primary amines  Organopnictogen compounds  Hydrocarbon derivatives  
Molecular Framework Aromatic heteropolycyclic compounds
Substituents 1,3-benzothiazole - Alkyl aryl ether - Benzenoid - 1,3-thiazol-2-amine - Azole - Thiazole - Heteroaromatic compound - Ether - Azacycle - Organopnictogen compound - Amine - Primary amine - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description This compound belongs to the class of organic compounds known as benzothiazoles. These are organic compounds containing a benzene fused to a thiazole ring (a five-membered ring with four carbon atoms, one nitrogen atom and one sulfur atom).
External Descriptors Not available

Associated Targets(Human)

TSHR Tclin Thyroid stimulating hormone receptor (29986 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
KCNH2 Tclin HERG (29587 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
PRKAA2 Tchem AMP-activated protein kinase, alpha-2 subunit (1328 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
AHR Tclin Aryl hydrocarbon receptor (1071 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
ALDH1A1 Tchem Aldehyde dehydrogenase 1A1 (77053 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
NR1H4 Tclin Bile acid receptor FXR (6228 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
CYP3A4 Tclin Cytochrome P450 3A4 (53859 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
TP53 Tchem Cellular tumor antigen p53 (48468 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
HSD17B10 Tchem Endoplasmic reticulum-associated amyloid beta-peptide-binding protein (20669 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Associated Targets(non-human)

Staphylococcus aureus (210822 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Escherichia coli (133304 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Enterococcus faecalis (29875 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Pichia kudriavzevii (7448 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Candida albicans (78123 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Candida parapsilosis (8521 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Candida tropicalis (8381 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Nfe2l2 Nuclear factor erythroid 2-related factor 2 (214 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Rorc Nuclear receptor ROR-gamma (89407 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Mechanisms of Action

Mechanism of Action Action Type target ID Target Name Target Type Target Organism Binding Site Name References

Names and Identifiers

Pubchem Sid 488180328
Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488180328
IUPAC Name 6-ethoxy-1,3-benzothiazol-2-amine
INCHI InChI=1S/C9H10N2OS/c1-2-12-6-3-4-7-8(5-6)13-9(10)11-7/h3-5H,2H2,1H3,(H2,10,11)
InChIKey KOYJWFGMEBETBU-UHFFFAOYSA-N
Smiles CCOC1=CC2=C(C=C1)N=C(S2)N
Isomeric SMILES CCOC1=CC2=C(C=C1)N=C(S2)N
Molecular Weight 194.25
Beilstein 27(2)335
Reaxy-Rn 142235
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=142235&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

6 results found

Lot Number Certificate Type Date Item
J1810103 Certificate of Analysis Aug 09, 2022 A151206
E2316868 Certificate of Analysis Aug 09, 2022 A151206
I2215016 Certificate of Analysis Jun 22, 2022 A151206
I2215018 Certificate of Analysis Jun 22, 2022 A151206
I2205017 Certificate of Analysis Jun 22, 2022 A151206
A2226014 Certificate of Analysis Feb 09, 2022 A151206

Chemical and Physical Properties

Melt Point(°C) 162.0-166.0℃
Molecular Weight 194.260 g/mol
XLogP3 2.800
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 194.051 Da
Monoisotopic Mass 194.051 Da
Topological Polar Surface Area 76.400 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 179.000
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
The total count of all stereochemical bonds 0
Covalently-Bonded Unit Count 1

Solution Calculators

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