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163110-42-7 | 1H-Benzimidazole, 4,5,6,7-tetrabromo-2-chloro-
CAS No: 163110-42-7 Catalog No: AG001TS5 MDL No:
Product Description
Catalog Number:
AG001TS5
Chemical Name:
1H-Benzimidazole, 4,5,6,7-tetrabromo-2-chloro-
CAS Number:
163110-42-7
Molecular Formula:
C7HBr4ClN2
Molecular Weight:
468.1652
IUPAC Name:
4,5,6,7-tetrabromo-2-chloro-1H-benzimidazole
InChI:
InChI=1S/C7HBr4ClN2/c8-1-2(9)4(11)6-5(3(1)10)13-7(12)14-6/h(H,13,14)
InChI Key:
IMXSFCWVBCNIAV-UHFFFAOYSA-N
SMILES:
Clc1[nH]c2c(n1)c(Br)c(c(c2Br)Br)Br
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
467.652g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
468.165g/mol
Monoisotopic Mass:
463.656g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
Literature
| Title | Journal |
|---|---|
| Tetraiodobenzimidazoles are potent inhibitors of protein kinase CK2. | Bioorganic & medicinal chemistry 20091015 |
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