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554425-27-3

554425-27-3 | 2-Pyridinecarboxamide,N-(4,5,6,7-tetrahydro-2-benzothiazolyl)-(9CI)

CAS No: 554425-27-3 Catalog No: AG00E8AX MDL No:

Product Description

Catalog Number:
AG00E8AX
Chemical Name:
2-Pyridinecarboxamide,N-(4,5,6,7-tetrahydro-2-benzothiazolyl)-(9CI)
CAS Number:
554425-27-3
IUPAC Name:
N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)pyridine-2-carboxamide
InChI:
InChI=1S/C13H13N3OS/c17-12(10-6-3-4-8-14-10)16-13-15-9-5-1-2-7-11(9)18-13/h3-4,6,8H,1-2,5,7H2,(H,15,16,17)
InChI Key:
SAEGHLBPLGKFOX-UHFFFAOYSA-N

Properties

Complexity:
313  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.078g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
259.327g/mol
Monoisotopic Mass:
259.078g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

Literature

Title Journal
Discovery and hit-to-lead optimization of novel allosteric glucokinase activators. Bioorganic & medicinal chemistry letters 20110915

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