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148673-66-9 | 2-Pyrazinecarboxamide, 6-chloro-N-2-pyrazinyl-
CAS No: 148673-66-9 Catalog No: AG001L45 MDL No:
Product Description
Catalog Number:
AG001L45
Chemical Name:
2-Pyrazinecarboxamide, 6-chloro-N-2-pyrazinyl-
CAS Number:
148673-66-9
Molecular Formula:
C9H6ClN5O
Molecular Weight:
235.6298
IUPAC Name:
6-chloro-N-pyrazin-2-ylpyrazine-2-carboxamide
InChI:
InChI=1S/C9H6ClN5O/c10-7-4-12-3-6(14-7)9(16)15-8-5-11-1-2-13-8/h1-5H,(H,13,15,16)
InChI Key:
CHDZXBIMUWFKTP-UHFFFAOYSA-N
SMILES:
Clc1cncc(n1)C(=O)Nc1nccnc1
Properties
Complexity:
252
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
235.026g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
235.631g/mol
Monoisotopic Mass:
235.026g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
80.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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