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Home Other Building Blocks Benzothiazole, 2-(4-pyridinyl)-

Benzothiazole, 2-(4-pyridinyl)-

CAS No.:
2295-38-7
Catalog Number:
AG002LNK
Molecular Formula:
C12H8N2S
Molecular Weight:
212.2703
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
1 week
United States
$364
- +
1g
98%
1 week
United States
$691
- +
Product Description
Catalog Number:
AG002LNK
Chemical Name:
Benzothiazole, 2-(4-pyridinyl)-
CAS Number:
2295-38-7
Molecular Formula:
C12H8N2S
Molecular Weight:
212.2703
MDL Number:
MFCD00569545
IUPAC Name:
2-pyridin-4-yl-1,3-benzothiazole
InChI:
InChI=1S/C12H8N2S/c1-2-4-11-10(3-1)14-12(15-11)9-5-7-13-8-6-9/h1-8H
InChI Key:
PDSIQRUYAXGTJG-UHFFFAOYSA-N
SMILES:
n1ccc(cc1)c1nc2c(s1)cccc2
NSC Number:
38712
Properties
Complexity:
216  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
212.041g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
212.27g/mol
Monoisotopic Mass:
212.041g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
Literature
Title Journal
Synthesis of novel inhibitors of β-glucuronidase based on benzothiazole skeleton and study of their binding affinity by molecular docking. Bioorganic & medicinal chemistry 20110715
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties