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955050-06-3 | 5-(4-METHYLPIPERAZIN-1-YL)-2-BROMOPYRAZINE
CAS No: 955050-06-3 Catalog No: AG006DD2 MDL No:
Product Description
Catalog Number:
AG006DD2
Chemical Name:
5-(4-METHYLPIPERAZIN-1-YL)-2-BROMOPYRAZINE
CAS Number:
955050-06-3
Molecular Formula:
C9H13BrN4
Molecular Weight:
257.1303
IUPAC Name:
2-bromo-5-(4-methylpiperazin-1-yl)pyrazine
InChI:
InChI=1S/C9H13BrN4/c1-13-2-4-14(5-3-13)9-7-11-8(10)6-12-9/h6-7H,2-5H2,1H3
InChI Key:
YVQREONPNAGFGC-UHFFFAOYSA-N
SMILES:
CN1CCN(CC1)c1ncc(nc1)Br
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
256.032g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
257.135g/mol
Monoisotopic Mass:
256.032g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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