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1216055-53-6

1216055-53-6 | "6-(1H-imidazol-1-yl)-1,3-benzothiazol-2-amine"

CAS No: 1216055-53-6 Catalog No: AG01FM2T MDL No:MFCD12403657

Product Description

Catalog Number:
AG01FM2T
Chemical Name:
"6-(1H-imidazol-1-yl)-1,3-benzothiazol-2-amine"
CAS Number:
1216055-53-6
Molecular Formula:
C10H8N4S
Molecular Weight:
216.2623
MDL Number:
MFCD12403657
IUPAC Name:
6-imidazol-1-yl-1,3-benzothiazol-2-amine
InChI:
InChI=1S/C10H8N4S/c11-10-13-8-2-1-7(5-9(8)15-10)14-4-3-12-6-14/h1-6H,(H2,11,13)
InChI Key:
QLBXOKFVCLZMEM-UHFFFAOYSA-N
SMILES:
Nc1nc2c(s1)cc(cc2)n1cncc1

Properties

Complexity:
238  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.047g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
216.262g/mol
Monoisotopic Mass:
216.047g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
85A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  

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