4-Bromo-6-chloro-2-methylbenzimidazole - CAS 1215205-57-4

Catalog:	BB005198
Product Name:	4-Bromo-6-chloro-2-methylbenzimidazole
CAS:	1215205-57-4
Synonyms:	4-bromo-6-chloro-2-methyl-1H-benzimidazole; 4-bromo-6-chloro-2-methyl-1H-benzimidazole

Technical Data

Patents

Computed Properties

IUPAC Name:	4-bromo-6-chloro-2-methyl-1H-benzimidazole
Description:	4-Bromo-6-chloro-2-methylbenzimidazole (CAS# 1215205-57-4) is a useful research chemical.
Molecular Weight:	245.50
Molecular Formula:	C8H6BrClN2
Canonical SMILES:	CC1=NC2=C(C=C(C=C2N1)Cl)Br
InChI:	InChI=1S/C8H6BrClN2/c1-4-11-7-3-5(10)2-6(9)8(7)12-4/h2-3H,1H3,(H,11,12)
InChI Key:	CXMZJEHRYZRXJA-UHFFFAOYSA-N
Storage:	Sealed in dry, 2-8 °C
LogP:	3.28720

Publication Number	Title	Priority Date
EP-2773640-A1	Bicyclic piperazine compounds	20111103
WO-2013067260-A1	Bicyclic piperazine compounds	20111103
CA-2844729-A1	Serine/threonine pak1 inhibitors	20110825
EP-2748159-A1	Serine/threonine pak1 inhibitors	20110825
JP-2014524456-A	Serine / threonine PAK1 inhibitor	20110825

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Related Functional Groups

Benzimidazoles

[39513-26-3]
5-Bromo-1,3-dihydrobenzoimidazol-2-one
[142356-64-7]
2-Amino-5-chloro-6-fluoro-1H-benzo[d]imidazole
[1245642-98-1]
4-Bromo-6-fluorobenzimidazole
[1225283-27-1]
4,5-difluoro-1H-1,3-benzodiazole-2-carboxylic acid
[29043-48-9]
6-Amino-2-methylbenzimidazole
[38385-95-4]
2-(4-Piperidyl)-1H-benzoimidazole

Complexity:	178
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	243.94029
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	1
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	243.94029
Rotatable Bond Count:	0
Topological Polar Surface Area:	28.7
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.2