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879547-28-1 | Pyrazinecarboxamide, 6-chloro-N-(4-methyl-2-thiazolyl)-
CAS No: 879547-28-1 Catalog No: AG004E96 MDL No:
Product Description
Catalog Number:
AG004E96
Chemical Name:
Pyrazinecarboxamide, 6-chloro-N-(4-methyl-2-thiazolyl)-
CAS Number:
879547-28-1
Molecular Formula:
C9H7ClN4OS
Molecular Weight:
254.6961
IUPAC Name:
6-chloro-N-(4-methyl-1,3-thiazol-2-yl)pyrazine-2-carboxamide
InChI:
InChI=1S/C9H7ClN4OS/c1-5-4-16-9(12-5)14-8(15)6-2-11-3-7(10)13-6/h2-4H,1H3,(H,12,14,15)
InChI Key:
ZTEVMLYIRIQKGQ-UHFFFAOYSA-N
SMILES:
Clc1cncc(n1)C(=O)Nc1scc(n1)C
Properties
Complexity:
268
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.003g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
254.692g/mol
Monoisotopic Mass:
254.003g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
96A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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