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Home > Bromides > 1818847-41-4
1818847-41-4 | 5H-Pyrrolo[2,3-b]pyrazine, 7-bromo-5-[(4-methylphenyl)sulfonyl]-
CAS No: 1818847-41-4 Catalog No: AG002360 MDL No:MFCD29060194
Product Description
Catalog Number:
AG002360
Chemical Name:
5H-Pyrrolo[2,3-b]pyrazine, 7-bromo-5-[(4-methylphenyl)sulfonyl]-
CAS Number:
1818847-41-4
Molecular Formula:
C13H10BrN3O2S
Molecular Weight:
352.2064
MDL Number:
MFCD29060194
IUPAC Name:
7-bromo-5-(4-methylphenyl)sulfonylpyrrolo[2,3-b]pyrazine
InChI:
InChI=1S/C13H10BrN3O2S/c1-9-2-4-10(5-3-9)20(18,19)17-8-11(14)12-13(17)16-7-6-15-12/h2-8H,1H3
InChI Key:
RZIHFWIVUHARMG-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)S(=O)(=O)n1cc(c2c1nccn2)Br
Properties
Complexity:
445
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
350.968g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
352.206g/mol
Monoisotopic Mass:
350.968g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
73.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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