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887475-71-0 | 6-Bromo-8-(methylthio);imidazo[1,2-a]pyrazine
CAS No: 887475-71-0 Catalog No: AG004F5G MDL No:MFCD11100003
Product Description
Catalog Number:
AG004F5G
Chemical Name:
6-Bromo-8-(methylthio);imidazo[1,2-a]pyrazine
CAS Number:
887475-71-0
Molecular Formula:
C7H6BrN3S
Molecular Weight:
244.1116
MDL Number:
MFCD11100003
IUPAC Name:
6-bromo-8-methylsulfanylimidazo[1,2-a]pyrazine
InChI:
InChI=1S/C7H6BrN3S/c1-12-7-6-9-2-3-11(6)4-5(8)10-7/h2-4H,1H3
InChI Key:
HWUMJZFDFAFXKB-UHFFFAOYSA-N
SMILES:
CSc1nc(Br)cn2c1ncc2
Properties
Complexity:
169
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.947g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.11g/mol
Monoisotopic Mass:
242.947g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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