4-Bromo-6-chloro-1H-indole - CAS 885519-23-3

Catalog:	BB038973
Product Name:	4-Bromo-6-chloro-1H-indole
CAS:	885519-23-3
Synonyms:	4-bromo-6-chloro-1H-indole; 4-bromo-6-chloro-1H-indole

Technical Data

Patents

Computed Properties

IUPAC Name:	4-bromo-6-chloro-1H-indole
Description:	4-Bromo-6-chloro-1H-indole (CAS# 885519-23-3) is a useful research chemical.
Molecular Weight:	230.49
Molecular Formula:	C8H5BrClN
Canonical SMILES:	C1=CNC2=CC(=CC(=C21)Br)Cl
InChI:	InChI=1S/C8H5BrClN/c9-7-3-5(10)4-8-6(7)1-2-11-8/h1-4,11H
InChI Key:	FWMOVLKMGUEKOT-UHFFFAOYSA-N
LogP:	3.58380

Publication Number	Title	Priority Date
WO-2018191146-A1	Heteroaryl rheb inhibitors and uses thereof	20170410
US-2021238165-A1	Heteroaryl rheb inhibitors and uses thereof	20170410
AU-2017221472-A1	Methods and compounds for restoring mutant p53 function	20160219
CA-3010847-A1	Methods and compounds for restoring mutant p53 function	20160219
EP-3416638-A1	METHODS AND COMPOUNDS FOR RESTORING MUTANT p53 FUNCTION	20160219

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Related Functional Groups

Indoles

[89908-23-6]
2-Propenoic acid, 2-(3',3'-dimethyl-6-nitrospiro[2H-1-benzopyran-2,2'-[2H]indol]-1'(3'H)-yl)ethyl ester
[119910-45-1]
2-bromo-1H-indole-3-carbaldehyde
[365547-91-7]
Ethyl 2-amino-5-chloro-1H-indole-3-carboxylate
[37033-95-7]
Ethyl 5-(benzyloxy)-1H-indole-2-carboxylate
[20538-12-9]
Ethyl 7-methoxy-1H-indole-2-carboxylate
[879-37-8]
Indole-3-acetamide

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Complexity:	153
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	228.92939
Formal Charge:	0
Heavy Atom Count:	11
Hydrogen Bond Acceptor Count:	0
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	228.92939
Rotatable Bond Count:	0
Topological Polar Surface Area:	15.8
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	3.4