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14397-13-8

14397-13-8 | 4-Pyridinecarboxamide, N-2-thiazolyl-

CAS No: 14397-13-8 Catalog No: AG001IOR MDL No:MFCD00116447

Product Description

Catalog Number:
AG001IOR
Chemical Name:
4-Pyridinecarboxamide, N-2-thiazolyl-
CAS Number:
14397-13-8
Molecular Formula:
C9H7N3OS
Molecular Weight:
205.2364
MDL Number:
MFCD00116447
IUPAC Name:
N-(1,3-thiazol-2-yl)pyridine-4-carboxamide
InChI:
InChI=1S/C9H7N3OS/c13-8(7-1-3-10-4-2-7)12-9-11-5-6-14-9/h1-6H,(H,11,12,13)
InChI Key:
IMBZIBAGEKPGDH-UHFFFAOYSA-N
SMILES:
O=C(c1ccncc1)Nc1nccs1

Properties

Complexity:
206  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
205.031g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
205.235g/mol
Monoisotopic Mass:
205.031g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
83.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  

Literature

Title Journal
Fragment-based discovery of 6-substituted isoquinolin-1-amine based ROCK-I inhibitors. Bioorganic & medicinal chemistry letters 20110101
Discovery and structural modification of inhibitors of methionine aminopeptidases from Escherichia coli and Saccharomyces cerevisiae. Journal of medicinal chemistry 20030619

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